methyl 2-[(2-methylphenyl)carbonylamino]-4-(4-propoxyphenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[(2-methylphenyl)carbonylamino]-4-(4-propoxyphenyl)thiophene-3-carboxylate Openeye Name: methyl 2-[(2-methylbenzoyl)amino]-4-(4-propoxyphenyl)thiophene-3-carboxylate CAS Name: 2-[[(2-methylphenyl)-oxomethyl]amino]-4-(4-propoxyphenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2-methylbenzoyl)amino]-4-(4-propoxyphenyl)thiophene-3-carboxylate Traditional Name: 2-(o-toluoylamino)-4-(4-propoxyphenyl)thiophene-3-carboxylic acid methyl ester Formula: C23H23NO4S MolecularWeight: 409.49802

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C3=CC=CC=C3C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C3=CC=CC=C3C

InChI

InChI=1S/C23H23NO4S/c1-4-13-28-17-11-9-16(10-12-17)19-14-29-22(20(19)23(26)27-3)24-21(25)18-8-6-5-7-15(18)2/h5-12,14H,4,13H2,1-3H3,(H,24,25)