methyl 2-(3-cyclopentylpropanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-(3-cyclopentylpropanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: methyl 2-(3-cyclopentylpropanoylamino)-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 2-[(3-cyclopentyl-1-oxopropyl)amino]-4-(4-methylphenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(3-cyclopentylpropanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-(3-cyclopentylpropanoylamino)-4-(p-tolyl)thiophene-3-carboxylic acid methyl ester Formula: C21H25NO3S MolecularWeight: 371.4931

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)CCC3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)CCC3CCCC3

InChI

InChI=1S/C21H25NO3S/c1-14-7-10-16(11-8-14)17-13-26-20(19(17)21(24)25-2)22-18(23)12-9-15-5-3-4-6-15/h7-8,10-11,13,15H,3-6,9,12H2,1-2H3,(H,22,23)