methyl 3-[3-[(3-chlorophenyl)amino]-5-methyl-2-sulfanylidene-1H-imidazol-4-yl]benzoate

Systemtic Name: methyl 3-[3-[(3-chlorophenyl)amino]-5-methyl-2-sulfanylidene-1H-imidazol-4-yl]benzoate Openeye Name: methyl 3-[3-(3-chloroanilino)-5-methyl-2-thioxo-1H-imidazol-4-yl]benzoate CAS Name: 3-[3-(3-chloroanilino)-5-methyl-2-sulfanylidene-1H-imidazol-4-yl]benzoic acid methyl ester IUPAC Name: methyl 3-[3-(3-chloroanilino)-5-methyl-2-sulfanylidene-1H-imidazol-4-yl]benzoate Traditional Name: 3-[3-(3-chloroanilino)-5-methyl-2-thioxo-4-imidazolin-4-yl]benzoic acid methyl ester Formula: C18H16ClN3O2S MolecularWeight: 373.85654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=S)N1)NC2=CC(=CC=C2)Cl)C3=CC(=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(N(C(=S)N1)NC2=CC(=CC=C2)Cl)C3=CC(=CC=C3)C(=O)OC

InChI

InChI=1S/C18H16ClN3O2S/c1-11-16(12-5-3-6-13(9-12)17(23)24-2)22(18(25)20-11)21-15-8-4-7-14(19)10-15/h3-10,21H,1-2H3,(H,20,25)