Mrv1652304272018532D 16 17 0 0 0 0 999 V2000 0.8250 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4125 -0.7144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4125 0.7144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3000 1.4290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8875 2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4125 -0.7144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4125 0.7144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8875 0.7144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0625 2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4125 2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0625 0.7144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 1.4290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 2.8579 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 1.4290 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 2 6 1 0 0 0 0 3 7 2 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 9 1 0 0 0 0 6 11 2 0 0 0 0 7 11 1 0 0 0 0 8 12 2 0 0 0 0 9 13 2 0 0 0 0 10 14 3 0 0 0 0 10 16 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 16 1 0 0 0 0 M END > CDB005765 > CDB > N#CSC1=CC=CC=C1NC1=CC=CC=C1 > InChI=1S/C13H10N2S/c14-10-16-13-9-5-4-8-12(13)15-11-6-2-1-3-7-11/h1-9,15H > CMJVGJCIBWJCTK-UHFFFAOYSA-N > C13H10N2S > 226.3 > 226.056469504 > 2 > 26 > 23.82279135676057 > 1 > 1 > 0 > 1 > {[2-(phenylamino)phenyl]sulfanyl}formonitrile > 3.85 > 3.710571332666666 > -3.70 > 0 > 2 > 0 > 18.659852056158545 > -0.6713895361575614 > 35.82 > 68.40960000000001 > 3 > 1 > 4.47e-02 g/l > {[2-(phenylamino)phenyl]sulfanyl}formonitrile > 1 > CDB005765 > 2-Thiocyanatodiphenylamine $$$$