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

Systemtic Name: 3-azanyl-N-(5-chloranyl-2,4-dimethoxy-phenyl)-4-cyano-5-[(4-methylphenyl)amino]thiophene-2-carboxamide Openeye Name: 3-amino-N-(5-chloro-2,4-dimethoxy-phenyl)-4-cyano-5-(4-methylanilino)thiophene-2-carboxamide CAS Name: 3-amino-N-(5-chloro-2,4-dimethoxyphenyl)-4-cyano-5-(4-methylanilino)-2-thiophenecarboxamide IUPAC Name: 3-amino-N-(5-chloro-2,4-dimethoxyphenyl)-4-cyano-5-(4-methylanilino)thiophene-2-carboxamide Traditional Name: 3-amino-N-(5-chloro-2,4-dimethoxy-phenyl)-4-cyano-5-(p-toluidino)thiophene-2-carboxamide Formula: C21H19ClN4O3S MolecularWeight: 442.91856

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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=C3OC)OC)Cl)N)C#N

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(C(=C(S2)C(=O)NC3=CC(=C(C=C3OC)OC)Cl)N)C#N

InChI

InChI=1S/C21H19ClN4O3S/c1-11-4-6-12(7-5-11)25-21-13(10-23)18(24)19(30-21)20(27)26-15-8-14(22)16(28-2)9-17(15)29-3/h4-9,25H,24H2,1-3H3,(H,26,27)