N-[4-(2-methylpropyl)-2-(3-oxidanylpiperazin-1-yl)phenyl]-1-phenyl-methanesulfonamide

Systemtic Name: N-[4-(2-methylpropyl)-2-(3-oxidanylpiperazin-1-yl)phenyl]-1-phenyl-methanesulfonamide Openeye Name: N-[2-(3-hydroxypiperazin-1-yl)-4-isobutyl-phenyl]-1-phenyl-methanesulfonamide CAS Name: N-[2-(3-hydroxy-1-piperazinyl)-4-(2-methylpropyl)phenyl]-1-phenylmethanesulfonamide IUPAC Name: N-[2-(3-hydroxypiperazin-1-yl)-4-(2-methylpropyl)phenyl]-1-phenylmethanesulfonamide Traditional Name: N-[2-(3-hydroxypiperazino)-4-isobutyl-phenyl]-1-phenyl-methanesulfonamide Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=C(C=C1)NS(=O)(=O)CC2=CC=CC=C2)N3CCNC(C3)O

Isomeric SMILES

CC(C)CC1=CC(=C(C=C1)NS(=O)(=O)CC2=CC=CC=C2)N3CCNC(C3)O

InChI

InChI=1S/C21H29N3O3S/c1-16(2)12-18-8-9-19(20(13-18)24-11-10-22-21(25)14-24)23-28(26,27)15-17-6-4-3-5-7-17/h3-9,13,16,21-23,25H,10-12,14-15H2,1-2H3