methyl 2-(3-cyclopentylpropanoylamino)-4-(3,4-dimethylphenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-(3-cyclopentylpropanoylamino)-4-(3,4-dimethylphenyl)thiophene-3-carboxylate Openeye Name: methyl 2-(3-cyclopentylpropanoylamino)-4-(3,4-dimethylphenyl)thiophene-3-carboxylate CAS Name: 2-[(3-cyclopentyl-1-oxopropyl)amino]-4-(3,4-dimethylphenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(3-cyclopentylpropanoylamino)-4-(3,4-dimethylphenyl)thiophene-3-carboxylate Traditional Name: 2-(3-cyclopentylpropanoylamino)-4-(3,4-dimethylphenyl)thiophene-3-carboxylic acid methyl ester Formula: C22H27NO3S MolecularWeight: 385.51968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27NO3S/c1-14-8-10-17(12-15(14)2)18-13-27-21(20(18)22(25)26-3)23-19(24)11-9-16-6-4-5-7-16/h8,10,12-13,16H,4-7,9,11H2,1-3H3,(H,23,24)