ethyl 2,4-dimethyl-5-[4-(1,3-thiazol-2-yl)piperazin-1-yl]carbonyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[4-(1,3-thiazol-2-yl)piperazin-1-yl]carbonyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-(4-thiazol-2-ylpiperazine-1-carbonyl)-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-[4-(2-thiazolyl)-1-piperazinyl]methyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[4-(1,3-thiazol-2-yl)piperazine-1-carbonyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-(4-thiazol-2-ylpiperazine-1-carbonyl)-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C17H22N4O3S MolecularWeight: 362.44658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)N2CCN(CC2)C3=NC=CS3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)N2CCN(CC2)C3=NC=CS3)C

InChI

InChI=1S/C17H22N4O3S/c1-4-24-16(23)13-11(2)14(19-12(13)3)15(22)20-6-8-21(9-7-20)17-18-5-10-25-17/h5,10,19H,4,6-9H2,1-3H3