[2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl] 2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrole-3-carboxylate

Systemtic Name: [2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl] 2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrole-3-carboxylate Openeye Name: [2-(4-acetamidoanilino)-2-oxo-ethyl] 2,5-dimethyl-1-thiazol-2-yl-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-(2-thiazolyl)-3-pyrrolecarboxylic acid [2-(4-acetamidoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-acetamidoanilino)-2-oxoethyl] 2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-thiazol-2-yl-pyrrole-3-carboxylic acid [2-(4-acetamidoanilino)-2-keto-ethyl] ester Formula: C20H20N4O4S MolecularWeight: 412.4622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=NC=CS2)C)C(=O)OCC(=O)NC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC1=CC(=C(N1C2=NC=CS2)C)C(=O)OCC(=O)NC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C20H20N4O4S/c1-12-10-17(13(2)24(12)20-21-8-9-29-20)19(27)28-11-18(26)23-16-6-4-15(5-7-16)22-14(3)25/h4-10H,11H2,1-3H3,(H,22,25)(H,23,26)