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

Systemtic Name: N-(1-methylpiperidin-4-yl)-4-[(3-methylsulfanylphenyl)amino]thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(1-methyl-4-piperidyl)-4-(3-methylsulfanylanilino)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(1-methyl-4-piperidinyl)-4-[3-(methylthio)anilino]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(1-methylpiperidin-4-yl)-4-(3-methylsulfanylanilino)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(1-methyl-4-piperidyl)-4-[3-(methylthio)anilino]thieno[2,3-d]pyrimidine-6-carboxamide Formula: C20H23N5OS2 MolecularWeight: 413.55952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N5OS2/c1-25-8-6-13(7-9-25)24-19(26)17-11-16-18(21-12-22-20(16)28-17)23-14-4-3-5-15(10-14)27-2/h3-5,10-13H,6-9H2,1-2H3,(H,24,26)(H,21,22,23)