ethyl 2-(2-cyclopentylsulfanylethanoylamino)-5-methyl-4-(4-methylphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-(2-cyclopentylsulfanylethanoylamino)-5-methyl-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[(2-cyclopentylsulfanylacetyl)amino]-5-methyl-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 2-[[2-(cyclopentylthio)-1-oxoethyl]amino]-5-methyl-4-(4-methylphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-cyclopentylsulfanylacetyl)amino]-5-methyl-4-(4-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-[[2-(cyclopentylthio)acetyl]amino]-5-methyl-4-(p-tolyl)thiophene-3-carboxylic acid ethyl ester Formula: C22H27NO3S2 MolecularWeight: 417.58468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)C)C)NC(=O)CSC3CCCC3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)C)C)NC(=O)CSC3CCCC3

InChI

InChI=1S/C22H27NO3S2/c1-4-26-22(25)20-19(16-11-9-14(2)10-12-16)15(3)28-21(20)23-18(24)13-27-17-7-5-6-8-17/h9-12,17H,4-8,13H2,1-3H3,(H,23,24)