3-azanyl-4-cyano-N-(3,4-dimethoxyphenyl)-5-[(4-methylphenyl)amino]thiophene-2-carboxamide

Systemtic Name: 3-azanyl-4-cyano-N-(3,4-dimethoxyphenyl)-5-[(4-methylphenyl)amino]thiophene-2-carboxamide Openeye Name: 3-amino-4-cyano-N-(3,4-dimethoxyphenyl)-5-(4-methylanilino)thiophene-2-carboxamide CAS Name: 3-amino-4-cyano-N-(3,4-dimethoxyphenyl)-5-(4-methylanilino)-2-thiophenecarboxamide IUPAC Name: 3-amino-4-cyano-N-(3,4-dimethoxyphenyl)-5-(4-methylanilino)thiophene-2-carboxamide Traditional Name: 3-amino-4-cyano-N-(3,4-dimethoxyphenyl)-5-(p-toluidino)thiophene-2-carboxamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(C(=C(S2)C(=O)NC3=CC(=C(C=C3)OC)OC)N)C#N

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(C(=C(S2)C(=O)NC3=CC(=C(C=C3)OC)OC)N)C#N

InChI

InChI=1S/C21H20N4O3S/c1-12-4-6-13(7-5-12)25-21-15(11-22)18(23)19(29-21)20(26)24-14-8-9-16(27-2)17(10-14)28-3/h4-10,25H,23H2,1-3H3,(H,24,26)