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

Systemtic Name: 3-azanyl-N-(2-chloranylpyridin-3-yl)-4-cyano-5-[(4-methylphenyl)amino]thiophene-2-carboxamide Openeye Name: 3-amino-N-(2-chloro-3-pyridyl)-4-cyano-5-(4-methylanilino)thiophene-2-carboxamide CAS Name: 3-amino-N-(2-chloro-3-pyridinyl)-4-cyano-5-(4-methylanilino)-2-thiophenecarboxamide IUPAC Name: 3-amino-N-(2-chloropyridin-3-yl)-4-cyano-5-(4-methylanilino)thiophene-2-carboxamide Traditional Name: 3-amino-N-(2-chloro-3-pyridyl)-4-cyano-5-(p-toluidino)thiophene-2-carboxamide Formula: C18H14ClN5OS MolecularWeight: 383.85466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14ClN5OS/c1-10-4-6-11(7-5-10)23-18-12(9-20)14(21)15(26-18)17(25)24-13-3-2-8-22-16(13)19/h2-8,23H,21H2,1H3,(H,24,25)