[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-[2-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]methanone

Systemtic Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-[2-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]methanone Openeye Name: [4-(p-tolylsulfonyl)piperazin-1-yl]-[2-(thiazol-4-ylmethylsulfanyl)phenyl]methanone CAS Name: [4-(4-methylphenyl)sulfonyl-1-piperazinyl]-[2-(4-thiazolylmethylthio)phenyl]methanone IUPAC Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-[2-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]methanone Traditional Name: [2-(thiazol-4-ylmethylthio)phenyl]-(4-tosylpiperazino)methanone Formula: C22H23N3O3S3 MolecularWeight: 473.63132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3SCC4=CSC=N4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3SCC4=CSC=N4

InChI

InChI=1S/C22H23N3O3S3/c1-17-6-8-19(9-7-17)31(27,28)25-12-10-24(11-13-25)22(26)20-4-2-3-5-21(20)30-15-18-14-29-16-23-18/h2-9,14,16H,10-13,15H2,1H3