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

Systemtic Name: 3-azanyl-4-cyano-5-[(4-methylphenyl)amino]-N-phenethyl-thiophene-2-carboxamide Openeye Name: 3-amino-4-cyano-5-(4-methylanilino)-N-phenethyl-thiophene-2-carboxamide CAS Name: 3-amino-4-cyano-5-(4-methylanilino)-N-phenethyl-2-thiophenecarboxamide IUPAC Name: 3-amino-4-cyano-5-(4-methylanilino)-N-phenethylthiophene-2-carboxamide Traditional Name: 3-amino-4-cyano-N-phenethyl-5-(p-toluidino)thiophene-2-carboxamide Formula: C21H20N4OS MolecularWeight: 376.4747

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(C(=C(S2)C(=O)NCCC3=CC=CC=C3)N)C#N

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(C(=C(S2)C(=O)NCCC3=CC=CC=C3)N)C#N

InChI

InChI=1S/C21H20N4OS/c1-14-7-9-16(10-8-14)25-21-17(13-22)18(23)19(27-21)20(26)24-12-11-15-5-3-2-4-6-15/h2-10,25H,11-12,23H2,1H3,(H,24,26)