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

Systemtic Name: 2-(4-methylphenyl)sulfonyl-5-propan-2-yl-1H-1,2,4-triazol-3-one Openeye Name: 5-isopropyl-2-(p-tolylsulfonyl)-1H-1,2,4-triazol-3-one CAS Name: 2-(4-methylphenyl)sulfonyl-5-propan-2-yl-1H-1,2,4-triazol-3-one IUPAC Name: 2-(4-methylphenyl)sulfonyl-5-propan-2-yl-1H-1,2,4-triazol-3-one Traditional Name: 5-isopropyl-2-tosyl-1H-1,2,4-triazol-3-one Formula: C12H15N3O3S MolecularWeight: 281.3308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N3O3S/c1-8(2)11-13-12(16)15(14-11)19(17,18)10-6-4-9(3)5-7-10/h4-8H,1-3H3,(H,13,14,16)