S-[5-[(4Z)-4-(1H-indol-3-ylmethylidene)-2-methyl-5-oxidanylidene-imidazol-1-yl]-1,3,4-thiadiazol-2-yl] 2-phenylazanylethanethioate

Systemtic Name: S-[5-[(4Z)-4-(1H-indol-3-ylmethylidene)-2-methyl-5-oxidanylidene-imidazol-1-yl]-1,3,4-thiadiazol-2-yl] 2-phenylazanylethanethioate Openeye Name: S-[5-[(4Z)-4-(1H-indol-3-ylmethylene)-2-methyl-5-oxo-imidazol-1-yl]-1,3,4-thiadiazol-2-yl] 2-anilinoethanethioate CAS Name: 2-anilinoethanethioic acid S-[5-[(4Z)-4-(1H-indol-3-ylmethylidene)-2-methyl-5-oxo-1-imidazolyl]-1,3,4-thiadiazol-2-yl] ester IUPAC Name: S-[5-[(4Z)-4-(1H-indol-3-ylmethylidene)-2-methyl-5-oxoimidazol-1-yl]-1,3,4-thiadiazol-2-yl] 2-anilinoethanethioate Traditional Name: 2-anilinoethanethioic acid S-[5-[(4Z)-4-(1H-indol-3-ylmethylene)-5-keto-2-methyl-2-imidazolin-1-yl]-1,3,4-thiadiazol-2-yl] ester Formula: C23H18N6O2S2 MolecularWeight: 474.55802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC2=CNC3=CC=CC=C32)C(=O)N1C4=NN=C(S4)SC(=O)CNC5=CC=CC=C5

Isomeric SMILES

CC1=N/C(=C\C2=CNC3=CC=CC=C32)/C(=O)N1C4=NN=C(S4)SC(=O)CNC5=CC=CC=C5

InChI

InChI=1S/C23H18N6O2S2/c1-14-26-19(11-15-12-25-18-10-6-5-9-17(15)18)21(31)29(14)22-27-28-23(33-22)32-20(30)13-24-16-7-3-2-4-8-16/h2-12,24-25H,13H2,1H3/b19-11-