ethyl 2-[(3-chlorophenyl)carbamoylamino]-4-(3,4-dimethylphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(3-chlorophenyl)carbamoylamino]-4-(3,4-dimethylphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[(3-chlorophenyl)carbamoylamino]-4-(3,4-dimethylphenyl)thiophene-3-carboxylate CAS Name: 2-[[(3-chloroanilino)-oxomethyl]amino]-4-(3,4-dimethylphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-chlorophenyl)carbamoylamino]-4-(3,4-dimethylphenyl)thiophene-3-carboxylate Traditional Name: 2-[(3-chlorophenyl)carbamoylamino]-4-(3,4-dimethylphenyl)thiophene-3-carboxylic acid ethyl ester Formula: C22H21ClN2O3S MolecularWeight: 428.93174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)C)C)NC(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)C)C)NC(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H21ClN2O3S/c1-4-28-21(26)19-18(15-9-8-13(2)14(3)10-15)12-29-20(19)25-22(27)24-17-7-5-6-16(23)11-17/h5-12H,4H2,1-3H3,(H2,24,25,27)