N-(2-methoxy-5-nitro-phenyl)-2,5-dimethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-2,5-dimethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(2-methoxy-5-nitro-phenyl)-2,5-dimethyl-4-(2-methyl-1-piperidyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(2-methoxy-5-nitrophenyl)-2,5-dimethyl-4-(2-methyl-1-piperidinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(2-methoxy-5-nitrophenyl)-2,5-dimethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(2-methoxy-5-nitro-phenyl)-2,5-dimethyl-4-(2-methylpiperidino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C22H25N5O4S MolecularWeight: 455.53

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C2=C3C(=C(SC3=NC(=N2)C)C(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])OC)C

Isomeric SMILES

CC1CCCCN1C2=C3C(=C(SC3=NC(=N2)C)C(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])OC)C

InChI

InChI=1S/C22H25N5O4S/c1-12-7-5-6-10-26(12)20-18-13(2)19(32-22(18)24-14(3)23-20)21(28)25-16-11-15(27(29)30)8-9-17(16)31-4/h8-9,11-12H,5-7,10H2,1-4H3,(H,25,28)