methyl 4-[2-[(4-acetamidophenyl)carbonylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[2-[(4-acetamidophenyl)carbonylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-[2-[(4-acetamidobenzoyl)amino]thiazol-4-yl]-1H-pyrrole-2-carboxylate CAS Name: 4-[2-[[(4-acetamidophenyl)-oxomethyl]amino]-4-thiazolyl]-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-[2-[(4-acetamidobenzoyl)amino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate Traditional Name: 4-[2-[(4-acetamidobenzoyl)amino]thiazol-4-yl]-1H-pyrrole-2-carboxylic acid methyl ester Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)NC2=NC(=CS2)C3=CNC(=C3)C(=O)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)NC2=NC(=CS2)C3=CNC(=C3)C(=O)OC

InChI

InChI=1S/C18H16N4O4S/c1-10(23)20-13-5-3-11(4-6-13)16(24)22-18-21-15(9-27-18)12-7-14(19-8-12)17(25)26-2/h3-9,19H,1-2H3,(H,20,23)(H,21,22,24)