methyl 2-[(4-azanyl-3-phenyl-2-sulfanylidene-1,3-thiazol-5-yl)carbonylamino]benzoate

Systemtic Name: methyl 2-[(4-azanyl-3-phenyl-2-sulfanylidene-1,3-thiazol-5-yl)carbonylamino]benzoate Openeye Name: methyl 2-[(4-amino-3-phenyl-2-thioxo-thiazole-5-carbonyl)amino]benzoate CAS Name: 2-[[(4-amino-3-phenyl-2-sulfanylidene-5-thiazolyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(4-amino-3-phenyl-2-sulfanylidene-1,3-thiazole-5-carbonyl)amino]benzoate Traditional Name: 2-[(4-amino-3-phenyl-2-thioxo-4-thiazoline-5-carbonyl)amino]benzoic acid methyl ester Formula: C18H15N3O3S2 MolecularWeight: 385.46

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C2=C(N(C(=S)S2)C3=CC=CC=C3)N

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)C2=C(N(C(=S)S2)C3=CC=CC=C3)N

InChI

InChI=1S/C18H15N3O3S2/c1-24-17(23)12-9-5-6-10-13(12)20-16(22)14-15(19)21(18(25)26-14)11-7-3-2-4-8-11/h2-10H,19H2,1H3,(H,20,22)