ethyl 2-[(1-cyclopentyl-5-oxidanylidene-pyrrolidin-2-yl)carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[(1-cyclopentyl-5-oxidanylidene-pyrrolidin-2-yl)carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[(1-cyclopentyl-5-oxo-pyrrolidine-2-carbonyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[(1-cyclopentyl-5-oxo-2-pyrrolidinyl)-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(1-cyclopentyl-5-oxopyrrolidine-2-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[(1-cyclopentyl-5-keto-prolyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3CCC(=O)N3C4CCCC4

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3CCC(=O)N3C4CCCC4

InChI

InChI=1S/C21H28N2O4S/c1-2-27-21(26)18-14-9-5-6-10-16(14)28-20(18)22-19(25)15-11-12-17(24)23(15)13-7-3-4-8-13/h13,15H,2-12H2,1H3,(H,22,25)