[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 4-(2-methyl-1,3-thiazol-4-yl)-1H-pyrrole-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 4-(2-methyl-1,3-thiazol-4-yl)-1H-pyrrole-2-carboxylate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 4-(2-methylthiazol-4-yl)-1H-pyrrole-2-carboxylate CAS Name: 4-(2-methyl-4-thiazolyl)-1H-pyrrole-2-carboxylic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 4-(2-methyl-1,3-thiazol-4-yl)-1H-pyrrole-2-carboxylate Traditional Name: 4-(2-methylthiazol-4-yl)-1H-pyrrole-2-carboxylic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)C1=CC(=CN1)C2=CSC(=N2)C

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)C1=CC(=CN1)C2=CSC(=N2)C

InChI

InChI=1S/C16H21N3O3S/c1-4-12(5-2)19-15(20)8-22-16(21)13-6-11(7-17-13)14-9-23-10(3)18-14/h6-7,9,12,17H,4-5,8H2,1-3H3,(H,19,20)