ethyl 2-[methyl-[3-[methyl(phenyl)amino]-3-sulfanylidene-propanoyl]amino]-5-pyrrol-1-yl-benzoate

Systemtic Name: ethyl 2-[methyl-[3-[methyl(phenyl)amino]-3-sulfanylidene-propanoyl]amino]-5-pyrrol-1-yl-benzoate Openeye Name: ethyl 2-[methyl-[3-(N-methylanilino)-3-thioxo-propanoyl]amino]-5-pyrrol-1-yl-benzoate CAS Name: 2-[methyl-[3-(N-methylanilino)-1-oxo-3-sulfanylidenepropyl]amino]-5-(1-pyrrolyl)benzoic acid ethyl ester IUPAC Name: ethyl 2-[methyl-[3-(N-methylanilino)-3-sulfanylidenepropanoyl]amino]-5-pyrrol-1-ylbenzoate Traditional Name: 2-[methyl-[3-(N-methylanilino)-3-thioxo-propanoyl]amino]-5-pyrrol-1-yl-benzoic acid ethyl ester Formula: C24H25N3O3S MolecularWeight: 435.5386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)N2C=CC=C2)N(C)C(=O)CC(=S)N(C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)N2C=CC=C2)N(C)C(=O)CC(=S)N(C)C3=CC=CC=C3

InChI

InChI=1S/C24H25N3O3S/c1-4-30-24(29)20-16-19(27-14-8-9-15-27)12-13-21(20)26(3)22(28)17-23(31)25(2)18-10-6-5-7-11-18/h5-16H,4,17H2,1-3H3