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

Systemtic Name: methyl 2-(hexanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: methyl 2-(hexanoylamino)-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 4-(4-methylphenyl)-2-(1-oxohexylamino)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(hexanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-(caproylamino)-4-(p-tolyl)thiophene-3-carboxylic acid methyl ester Formula: C19H23NO3S MolecularWeight: 345.45582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23NO3S/c1-4-5-6-7-16(21)20-18-17(19(22)23-3)15(12-24-18)14-10-8-13(2)9-11-14/h8-12H,4-7H2,1-3H3,(H,20,21)