ethyl 3-azanyl-4-[(3-methoxyphenyl)carbamoyl]-5-[(4-methylphenyl)amino]thiophene-2-carboxylate

Systemtic Name: ethyl 3-azanyl-4-[(3-methoxyphenyl)carbamoyl]-5-[(4-methylphenyl)amino]thiophene-2-carboxylate Openeye Name: ethyl 3-amino-4-[(3-methoxyphenyl)carbamoyl]-5-(4-methylanilino)thiophene-2-carboxylate CAS Name: 3-amino-4-[(3-methoxyanilino)-oxomethyl]-5-(4-methylanilino)-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-amino-4-[(3-methoxyphenyl)carbamoyl]-5-(4-methylanilino)thiophene-2-carboxylate Traditional Name: 3-amino-4-[(3-methoxyphenyl)carbamoyl]-5-(p-toluidino)thiophene-2-carboxylic acid ethyl ester Formula: C22H23N3O4S MolecularWeight: 425.50072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC2=CC=C(C=C2)C)C(=O)NC3=CC(=CC=C3)OC)N

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC2=CC=C(C=C2)C)C(=O)NC3=CC(=CC=C3)OC)N

InChI

InChI=1S/C22H23N3O4S/c1-4-29-22(27)19-18(23)17(20(26)24-15-6-5-7-16(12-15)28-3)21(30-19)25-14-10-8-13(2)9-11-14/h5-12,25H,4,23H2,1-3H3,(H,24,26)