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

Systemtic Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-(1-phenyl-1,2,3-triazol-4-yl)methanone Openeye Name: (1-phenyltriazol-4-yl)-[4-(p-tolylsulfonyl)piperazin-1-yl]methanone CAS Name: [4-(4-methylphenyl)sulfonyl-1-piperazinyl]-(1-phenyl-4-triazolyl)methanone IUPAC Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-(1-phenyltriazol-4-yl)methanone Traditional Name: (1-phenyltriazol-4-yl)-(4-tosylpiperazino)methanone Formula: C20H21N5O3S MolecularWeight: 411.47744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CN(N=N3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CN(N=N3)C4=CC=CC=C4

InChI

InChI=1S/C20H21N5O3S/c1-16-7-9-18(10-8-16)29(27,28)24-13-11-23(12-14-24)20(26)19-15-25(22-21-19)17-5-3-2-4-6-17/h2-10,15H,11-14H2,1H3