4-tert-butyl-N-[2-methoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-3-nitro-benzamide

Systemtic Name: 4-tert-butyl-N-[2-methoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-3-nitro-benzamide Openeye Name: 4-tert-butyl-N-[2-methoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-3-nitro-benzamide CAS Name: 4-tert-butyl-N-[2-methoxy-5-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-3-nitrobenzamide IUPAC Name: 4-tert-butyl-N-[2-methoxy-5-(4-methylpiperazin-1-yl)sulfonylphenyl]-3-nitrobenzamide Traditional Name: 4-tert-butyl-N-[2-methoxy-5-(4-methylpiperazino)sulfonyl-phenyl]-3-nitro-benzamide Formula: C23H30N4O6S MolecularWeight: 490.5725

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H30N4O6S/c1-23(2,3)18-8-6-16(14-20(18)27(29)30)22(28)24-19-15-17(7-9-21(19)33-5)34(31,32)26-12-10-25(4)11-13-26/h6-9,14-15H,10-13H2,1-5H3,(H,24,28)