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

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-5-methyl-4-(4-phenylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(2-methoxy-5-nitro-phenyl)-5-methyl-4-(4-phenylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(2-methoxy-5-nitrophenyl)-5-methyl-4-(4-phenyl-1-piperazinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(2-methoxy-5-nitrophenyl)-5-methyl-4-(4-phenylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(2-methoxy-5-nitro-phenyl)-5-methyl-4-(4-phenylpiperazino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C25H24N6O4S MolecularWeight: 504.56086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CCN(CC3)C4=CC=CC=C4)C(=O)NC5=C(C=CC(=C5)[N+](=O)[O-])OC

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCN(CC3)C4=CC=CC=C4)C(=O)NC5=C(C=CC(=C5)[N+](=O)[O-])OC

InChI

InChI=1S/C25H24N6O4S/c1-16-21-23(30-12-10-29(11-13-30)17-6-4-3-5-7-17)26-15-27-25(21)36-22(16)24(32)28-19-14-18(31(33)34)8-9-20(19)35-2/h3-9,14-15H,10-13H2,1-2H3,(H,28,32)