[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-[4-(phenylsulfanylmethyl)phenyl]methanone

Systemtic Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-[4-(phenylsulfanylmethyl)phenyl]methanone Openeye Name: [4-(phenylsulfanylmethyl)phenyl]-[4-(p-tolylsulfonyl)piperazin-1-yl]methanone CAS Name: [4-(4-methylphenyl)sulfonyl-1-piperazinyl]-[4-[(phenylthio)methyl]phenyl]methanone IUPAC Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-[4-(phenylsulfanylmethyl)phenyl]methanone Traditional Name: [4-[(phenylthio)methyl]phenyl]-(4-tosylpiperazino)methanone Formula: C25H26N2O3S2 MolecularWeight: 466.61554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CSC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CSC4=CC=CC=C4

InChI

InChI=1S/C25H26N2O3S2/c1-20-7-13-24(14-8-20)32(29,30)27-17-15-26(16-18-27)25(28)22-11-9-21(10-12-22)19-31-23-5-3-2-4-6-23/h2-14H,15-19H2,1H3