methyl 2-[3-(4-methoxyphenyl)propanoylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[3-(4-methoxyphenyl)propanoylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[3-(4-methoxyphenyl)propanoylamino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[3-(4-methoxyphenyl)-1-oxopropyl]amino]-5-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[3-(4-methoxyphenyl)propanoylamino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[3-(4-methoxyphenyl)propanoylamino]-5-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C22H21NO4S MolecularWeight: 395.47144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(=O)NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)CCC(=O)NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C22H21NO4S/c1-26-17-11-8-15(9-12-17)10-13-20(24)23-21-18(22(25)27-2)14-19(28-21)16-6-4-3-5-7-16/h3-9,11-12,14H,10,13H2,1-2H3,(H,23,24)