S-[(5Z)-4-(4-chlorophenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl] 2-chloranylbenzenecarbothioate

Systemtic Name: S-[(5Z)-4-(4-chlorophenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl] 2-chloranylbenzenecarbothioate Openeye Name: S-[(5Z)-4-(4-chlorophenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl] 2-chlorobenzenecarbothioate CAS Name: 2-chlorobenzenecarbothioic acid S-[(5Z)-4-(4-chlorophenyl)-5-(3-indolylidene)-1H-1,2,4-triazol-3-yl] ester IUPAC Name: S-[(5Z)-4-(4-chlorophenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl] 2-chlorobenzenecarbothioate Traditional Name: 2-chlorothiobenzoic acid S-[(5Z)-4-(4-chlorophenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl] ester Formula: C23H14Cl2N4OS MolecularWeight: 465.35446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3NN=C(N3C4=CC=C(C=C4)Cl)SC(=O)C5=CC=CC=C5Cl)C=N2

Isomeric SMILES

C1=CC=C2C(=C1)/C(=C\3/NN=C(N3C4=CC=C(C=C4)Cl)SC(=O)C5=CC=CC=C5Cl)/C=N2

InChI

InChI=1S/C23H14Cl2N4OS/c24-14-9-11-15(12-10-14)29-21(18-13-26-20-8-4-2-5-16(18)20)27-28-23(29)31-22(30)17-6-1-3-7-19(17)25/h1-13,27H/b21-18-