methyl 5-(dipropylcarbamoyl)-4-methyl-2-[(2-methylphenyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-(dipropylcarbamoyl)-4-methyl-2-[(2-methylphenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 5-(dipropylcarbamoyl)-4-methyl-2-[(2-methylbenzoyl)amino]thiophene-3-carboxylate CAS Name: 5-[(dipropylamino)-oxomethyl]-4-methyl-2-[[(2-methylphenyl)-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(dipropylcarbamoyl)-4-methyl-2-[(2-methylbenzoyl)amino]thiophene-3-carboxylate Traditional Name: 5-(dipropylcarbamoyl)-4-methyl-2-(o-toluoylamino)thiophene-3-carboxylic acid methyl ester Formula: C22H28N2O4S MolecularWeight: 416.53372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC=CC=C2C)C(=O)OC)C

Isomeric SMILES

CCCN(CCC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC=CC=C2C)C(=O)OC)C

InChI

InChI=1S/C22H28N2O4S/c1-6-12-24(13-7-2)21(26)18-15(4)17(22(27)28-5)20(29-18)23-19(25)16-11-9-8-10-14(16)3/h8-11H,6-7,12-13H2,1-5H3,(H,23,25)