3-methyl-1-(4-methylphenyl)sulfonyl-4-(2-methylpropyl)-1,2,4-triazine-5,6-dione

Systemtic Name: 3-methyl-1-(4-methylphenyl)sulfonyl-4-(2-methylpropyl)-1,2,4-triazine-5,6-dione Openeye Name: 4-isobutyl-3-methyl-1-(p-tolylsulfonyl)-1,2,4-triazine-5,6-dione CAS Name: 3-methyl-1-(4-methylphenyl)sulfonyl-4-(2-methylpropyl)-1,2,4-triazine-5,6-dione IUPAC Name: 3-methyl-1-(4-methylphenyl)sulfonyl-4-(2-methylpropyl)-1,2,4-triazine-5,6-dione Traditional Name: 4-isobutyl-3-methyl-1-tosyl-1,2,4-triazine-5,6-quinone Formula: C15H19N3O4S MolecularWeight: 337.39406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N3O4S/c1-10(2)9-17-12(4)16-18(15(20)14(17)19)23(21,22)13-7-5-11(3)6-8-13/h5-8,10H,9H2,1-4H3