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

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(2-methoxy-5-nitro-phenyl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(2-methoxy-5-nitrophenyl)-4-[4-(4-methoxyphenyl)-1-piperazinyl]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(2-methoxy-5-nitrophenyl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(2-methoxy-5-nitro-phenyl)-4-[4-(4-methoxyphenyl)piperazino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C26H26N6O5S MolecularWeight: 534.58684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H26N6O5S/c1-16-22-24(31-12-10-30(11-13-31)17-4-7-19(36-2)8-5-17)27-15-28-26(22)38-23(16)25(33)29-20-14-18(32(34)35)6-9-21(20)37-3/h4-9,14-15H,10-13H2,1-3H3,(H,29,33)