N'-(4-butylphenyl)-N-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethyl]ethanediamide

Systemtic Name: N'-(4-butylphenyl)-N-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethyl]ethanediamide Openeye Name: N'-(4-butylphenyl)-N-[2-[4-(2-naphthylsulfonyl)piperazin-1-yl]ethyl]oxamide CAS Name: N'-(4-butylphenyl)-N-[2-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]ethyl]oxamide IUPAC Name: N'-(4-butylphenyl)-N-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethyl]oxamide Traditional Name: N'-(4-butylphenyl)-N-[2-[4-(2-naphthylsulfonyl)piperazino]ethyl]oxamide Formula: C28H34N4O4S MolecularWeight: 522.65896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C(=O)NCCN2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C(=O)NCCN2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C28H34N4O4S/c1-2-3-6-22-9-12-25(13-10-22)30-28(34)27(33)29-15-16-31-17-19-32(20-18-31)37(35,36)26-14-11-23-7-4-5-8-24(23)21-26/h4-5,7-14,21H,2-3,6,15-20H2,1H3,(H,29,33)(H,30,34)