ethyl 4,5-dimethyl-2-[[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-[[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazine-1-carbonyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[oxo-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazinyl]methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazine-1-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[4-(2-keto-2-pyrrolidino-ethyl)piperazine-1-carbonyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C20H30N4O4S MolecularWeight: 422.5416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)N2CCN(CC2)CC(=O)N3CCCC3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)N2CCN(CC2)CC(=O)N3CCCC3

InChI

InChI=1S/C20H30N4O4S/c1-4-28-19(26)17-14(2)15(3)29-18(17)21-20(27)24-11-9-22(10-12-24)13-16(25)23-7-5-6-8-23/h4-13H2,1-3H3,(H,21,27)