4-[(3-chlorophenyl)amino]-N-(1-methylpiperidin-4-yl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 4-[(3-chlorophenyl)amino]-N-(1-methylpiperidin-4-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 4-(3-chloroanilino)-N-(1-methyl-4-piperidyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 4-(3-chloroanilino)-N-(1-methyl-4-piperidinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 4-(3-chloroanilino)-N-(1-methylpiperidin-4-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 4-(3-chloroanilino)-N-(1-methyl-4-piperidyl)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C19H20ClN5OS MolecularWeight: 401.913

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)NC(=O)C2=CC3=C(N=CN=C3S2)NC4=CC(=CC=C4)Cl

Isomeric SMILES

CN1CCC(CC1)NC(=O)C2=CC3=C(N=CN=C3S2)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C19H20ClN5OS/c1-25-7-5-13(6-8-25)24-18(26)16-10-15-17(21-11-22-19(15)27-16)23-14-4-2-3-12(20)9-14/h2-4,9-11,13H,5-8H2,1H3,(H,24,26)(H,21,22,23)