4,7-dimethoxy-N-[2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 4,7-dimethoxy-N-[2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 4,7-dimethoxy-N-[2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]phenyl]benzothiophene-2-carboxamide CAS Name: 4,7-dimethoxy-N-[2-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 4,7-dimethoxy-N-[2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 4,7-dimethoxy-N-[2-[[4-(4-nitrophenyl)piperazino]methyl]phenyl]benzothiophene-2-carboxamide Formula: C28H28N4O5S MolecularWeight: 532.61072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C=C(SC2=C(C=C1)OC)C(=O)NC3=CC=CC=C3CN4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=C2C=C(SC2=C(C=C1)OC)C(=O)NC3=CC=CC=C3CN4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C28H28N4O5S/c1-36-24-11-12-25(37-2)27-22(24)17-26(38-27)28(33)29-23-6-4-3-5-19(23)18-30-13-15-31(16-14-30)20-7-9-21(10-8-20)32(34)35/h3-12,17H,13-16,18H2,1-2H3,(H,29,33)