N-[3-(4-methylpiperazin-1-yl)propyl]-4-[[methylsulfonyl(phenyl)amino]methyl]benzamide

Systemtic Name: N-[3-(4-methylpiperazin-1-yl)propyl]-4-[[methylsulfonyl(phenyl)amino]methyl]benzamide Openeye Name: N-[3-(4-methylpiperazin-1-yl)propyl]-4-[(N-methylsulfonylanilino)methyl]benzamide CAS Name: N-[3-(4-methyl-1-piperazinyl)propyl]-4-[(N-methylsulfonylanilino)methyl]benzamide IUPAC Name: N-[3-(4-methylpiperazin-1-yl)propyl]-4-[(N-methylsulfonylanilino)methyl]benzamide Traditional Name: 4-[(N-mesylanilino)methyl]-N-[3-(4-methylpiperazino)propyl]benzamide Formula: C23H32N4O3S MolecularWeight: 444.59018

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCNC(=O)C2=CC=C(C=C2)CN(C3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CN1CCN(CC1)CCCNC(=O)C2=CC=C(C=C2)CN(C3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C23H32N4O3S/c1-25-15-17-26(18-16-25)14-6-13-24-23(28)21-11-9-20(10-12-21)19-27(31(2,29)30)22-7-4-3-5-8-22/h3-5,7-12H,6,13-19H2,1-2H3,(H,24,28)