N-(3-chlorophenyl)-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(3-chlorophenyl)-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(3-chlorophenyl)-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(3-chlorophenyl)-5-methyl-4-(4-methyl-1-piperazinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(3-chlorophenyl)-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(3-chlorophenyl)-5-methyl-4-(4-methylpiperazino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C19H20ClN5OS MolecularWeight: 401.913

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CCN(CC3)C)C(=O)NC4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCN(CC3)C)C(=O)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C19H20ClN5OS/c1-12-15-17(25-8-6-24(2)7-9-25)21-11-22-19(15)27-16(12)18(26)23-14-5-3-4-13(20)10-14/h3-5,10-11H,6-9H2,1-2H3,(H,23,26)