2-[1-(4-methoxyphenyl)sulfonyloctylamino]-3-[(2-methylpiperazin-1-yl)methyl]benzamide

Systemtic Name: 2-[1-(4-methoxyphenyl)sulfonyloctylamino]-3-[(2-methylpiperazin-1-yl)methyl]benzamide Openeye Name: 2-[1-(4-methoxyphenyl)sulfonyloctylamino]-3-[(2-methylpiperazin-1-yl)methyl]benzamide CAS Name: 2-[1-(4-methoxyphenyl)sulfonyloctylamino]-3-[(2-methyl-1-piperazinyl)methyl]benzamide IUPAC Name: 2-[1-(4-methoxyphenyl)sulfonyloctylamino]-3-[(2-methylpiperazin-1-yl)methyl]benzamide Traditional Name: 2-[1-(4-methoxyphenyl)sulfonyloctylamino]-3-[(2-methylpiperazino)methyl]benzamide Formula: C28H42N4O4S MolecularWeight: 530.72248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(NC1=C(C=CC=C1CN2CCNCC2C)C(=O)N)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCCCCCC(NC1=C(C=CC=C1CN2CCNCC2C)C(=O)N)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C28H42N4O4S/c1-4-5-6-7-8-12-26(37(34,35)24-15-13-23(36-3)14-16-24)31-27-22(10-9-11-25(27)28(29)33)20-32-18-17-30-19-21(32)2/h9-11,13-16,21,26,30-31H,4-8,12,17-20H2,1-3H3,(H2,29,33)