3-[4-(2-hydroxyphenyl)piperazin-1-yl]carbonyl-4-methyl-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 3-[4-(2-hydroxyphenyl)piperazin-1-yl]carbonyl-4-methyl-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-3-[4-(2-hydroxyphenyl)piperazine-1-carbonyl]-4-methyl-benzenesulfonamide CAS Name: 3-[[4-(2-hydroxyphenyl)-1-piperazinyl]-oxomethyl]-4-methyl-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-3-[4-(2-hydroxyphenyl)piperazine-1-carbonyl]-4-methylbenzenesulfonamide Traditional Name: N-benzyl-3-[4-(2-hydroxyphenyl)piperazine-1-carbonyl]-4-methyl-benzenesulfonamide Formula: C25H27N3O4S MolecularWeight: 465.56458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4O

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4O

InChI

InChI=1S/C25H27N3O4S/c1-19-11-12-21(33(31,32)26-18-20-7-3-2-4-8-20)17-22(19)25(30)28-15-13-27(14-16-28)23-9-5-6-10-24(23)29/h2-12,17,26,29H,13-16,18H2,1H3