methyl 2-[3-(4-propan-2-ylphenyl)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: methyl 2-[3-(4-propan-2-ylphenyl)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: methyl 2-[3-(4-isopropylphenyl)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[1-oxo-3-(4-propan-2-ylphenyl)propyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[3-(4-propan-2-ylphenyl)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-(3-p-cumenylpropanoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester Formula: C21H25NO3S MolecularWeight: 371.4931

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CCC(=O)NC2=C(C3=C(S2)CCC3)C(=O)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CCC(=O)NC2=C(C3=C(S2)CCC3)C(=O)OC

InChI

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