methyl 5-[[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[[4-(4-acetamidophenyl)thiazol-2-yl]carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate CAS Name: 5-[[[4-(4-acetamidophenyl)-2-thiazolyl]amino]-oxomethyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[[4-(4-acetamidophenyl)thiazol-2-yl]carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)NC(=O)C)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)NC(=O)C)C)C(=O)OC

InChI

InChI=1S/C21H22N4O4S/c1-5-15-17(20(28)29-4)11(2)18(23-15)19(27)25-21-24-16(10-30-21)13-6-8-14(9-7-13)22-12(3)26/h6-10,23H,5H2,1-4H3,(H,22,26)(H,24,25,27)