[1-[(3-cyanothiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl] 1-(4-chlorophenyl)cyclopentane-1-carboxylate

Systemtic Name: [1-[(3-cyanothiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl] 1-(4-chlorophenyl)cyclopentane-1-carboxylate Openeye Name: [2-[(3-cyano-2-thienyl)amino]-1-methyl-2-oxo-ethyl] 1-(4-chlorophenyl)cyclopentanecarboxylate CAS Name: 1-(4-chlorophenyl)-1-cyclopentanecarboxylic acid [1-[(3-cyano-2-thiophenyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(3-cyanothiophen-2-yl)amino]-1-oxopropan-2-yl] 1-(4-chlorophenyl)cyclopentane-1-carboxylate Traditional Name: 1-(4-chlorophenyl)cyclopentanecarboxylic acid [2-[(3-cyano-2-thienyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C20H19ClN2O3S MolecularWeight: 402.89446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CS1)C#N)OC(=O)C2(CCCC2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C(=O)NC1=C(C=CS1)C#N)OC(=O)C2(CCCC2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H19ClN2O3S/c1-13(17(24)23-18-14(12-22)8-11-27-18)26-19(25)20(9-2-3-10-20)15-4-6-16(21)7-5-15/h4-8,11,13H,2-3,9-10H2,1H3,(H,23,24)