4-(2-methylphenoxy)-N-phenyl-N-piperazin-1-yl-butane-1-sulfonamide

Systemtic Name: 4-(2-methylphenoxy)-N-phenyl-N-piperazin-1-yl-butane-1-sulfonamide Openeye Name: 4-(2-methylphenoxy)-N-phenyl-N-piperazin-1-yl-butane-1-sulfonamide CAS Name: 4-(2-methylphenoxy)-N-phenyl-N-(1-piperazinyl)-1-butanesulfonamide IUPAC Name: 4-(2-methylphenoxy)-N-phenyl-N-piperazin-1-ylbutane-1-sulfonamide Traditional Name: 4-(2-methylphenoxy)-N-phenyl-N-piperazino-butane-1-sulfonamide Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCCCS(=O)(=O)N(C2=CC=CC=C2)N3CCNCC3

Isomeric SMILES

CC1=CC=CC=C1OCCCCS(=O)(=O)N(C2=CC=CC=C2)N3CCNCC3

InChI

InChI=1S/C21H29N3O3S/c1-19-9-5-6-12-21(19)27-17-7-8-18-28(25,26)24(20-10-3-2-4-11-20)23-15-13-22-14-16-23/h2-6,9-12,22H,7-8,13-18H2,1H3