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

Systemtic Name: methyl 2-(heptanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: methyl 2-(heptanoylamino)-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 4-(4-methylphenyl)-2-(1-oxoheptylamino)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(heptanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-(enanthylamino)-4-(p-tolyl)thiophene-3-carboxylic acid methyl ester Formula: C20H25NO3S MolecularWeight: 359.4824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)C)C(=O)OC

Isomeric SMILES

CCCCCCC(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)C)C(=O)OC

InChI

InChI=1S/C20H25NO3S/c1-4-5-6-7-8-17(22)21-19-18(20(23)24-3)16(13-25-19)15-11-9-14(2)10-12-15/h9-13H,4-8H2,1-3H3,(H,21,22)