4-(4-methylpiperidin-1-yl)-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]-3-nitro-benzamide

Systemtic Name: 4-(4-methylpiperidin-1-yl)-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]-3-nitro-benzamide Openeye Name: 4-(4-methyl-1-piperidyl)-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]-3-nitro-benzamide CAS Name: 4-(4-methyl-1-piperidinyl)-N-[2-(4-methylsulfonyl-1-piperazinyl)phenyl]-3-nitrobenzamide IUPAC Name: 4-(4-methylpiperidin-1-yl)-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]-3-nitrobenzamide Traditional Name: N-[2-(4-mesylpiperazino)phenyl]-4-(4-methylpiperidino)-3-nitro-benzamide Formula: C24H31N5O5S MolecularWeight: 501.59844

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3N4CCN(CC4)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3N4CCN(CC4)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C24H31N5O5S/c1-18-9-11-26(12-10-18)22-8-7-19(17-23(22)29(31)32)24(30)25-20-5-3-4-6-21(20)27-13-15-28(16-14-27)35(2,33)34/h3-8,17-18H,9-16H2,1-2H3,(H,25,30)