2-(4-methylphenyl)sulfonyl-5-(phenylmethyl)-1H-1,2,4-triazol-3-one

Systemtic Name: 2-(4-methylphenyl)sulfonyl-5-(phenylmethyl)-1H-1,2,4-triazol-3-one Openeye Name: 5-benzyl-2-(p-tolylsulfonyl)-1H-1,2,4-triazol-3-one CAS Name: 2-(4-methylphenyl)sulfonyl-5-(phenylmethyl)-1H-1,2,4-triazol-3-one IUPAC Name: 5-benzyl-2-(4-methylphenyl)sulfonyl-1H-1,2,4-triazol-3-one Traditional Name: 5-benzyl-2-tosyl-1H-1,2,4-triazol-3-one Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(=O)N=C(N2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(=O)N=C(N2)CC3=CC=CC=C3

InChI

InChI=1S/C16H15N3O3S/c1-12-7-9-14(10-8-12)23(21,22)19-16(20)17-15(18-19)11-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,17,18,20)