ethyl 2-[[2-(cyclopentylamino)-2-oxidanylidene-ethanoyl]amino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[2-(cyclopentylamino)-2-oxidanylidene-ethanoyl]amino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(cyclopentylamino)-2-oxo-acetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-(cyclopentylamino)-1,2-dioxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(cyclopentylamino)-2-oxoacetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(cyclopentylamino)-2-keto-acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C(=O)NC3CCCC3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C(=O)NC3CCCC3

InChI

InChI=1S/C20H22N2O4S/c1-2-26-20(25)16-15(13-8-4-3-5-9-13)12-27-19(16)22-18(24)17(23)21-14-10-6-7-11-14/h3-5,8-9,12,14H,2,6-7,10-11H2,1H3,(H,21,23)(H,22,24)