[2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrole-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrole-3-carboxylate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 2,5-dimethyl-1-(2-thienylmethyl)pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-(thiophen-2-ylmethyl)-3-pyrrolecarboxylic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-(2-thenyl)pyrrole-3-carboxylic acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C18H23N3O4S MolecularWeight: 377.45792

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)COC(=O)C1=C(N(C(=C1)C)CC2=CC=CS2)C

Isomeric SMILES

CCCNC(=O)NC(=O)COC(=O)C1=C(N(C(=C1)C)CC2=CC=CS2)C

InChI

InChI=1S/C18H23N3O4S/c1-4-7-19-18(24)20-16(22)11-25-17(23)15-9-12(2)21(13(15)3)10-14-6-5-8-26-14/h5-6,8-9H,4,7,10-11H2,1-3H3,(H2,19,20,22,24)