methyl 4-[2-(2-pyrrol-1-yl-1,3-thiazol-5-yl)ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(2-pyrrol-1-yl-1,3-thiazol-5-yl)ethanoylamino]benzoate Openeye Name: methyl 4-[[2-(2-pyrrol-1-ylthiazol-5-yl)acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[2-(1-pyrrolyl)-5-thiazolyl]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(2-pyrrol-1-yl-1,3-thiazol-5-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(2-pyrrol-1-ylthiazol-5-yl)acetyl]amino]benzoic acid methyl ester Formula: C17H15N3O3S MolecularWeight: 341.3843

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CC2=CN=C(S2)N3C=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CC2=CN=C(S2)N3C=CC=C3

InChI

InChI=1S/C17H15N3O3S/c1-23-16(22)12-4-6-13(7-5-12)19-15(21)10-14-11-18-17(24-14)20-8-2-3-9-20/h2-9,11H,10H2,1H3,(H,19,21)