3-[(2R)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[(2R)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[(1R)-1-methyl-2-oxo-2-(p-tolyl)ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[(2R)-1-(4-methylphenyl)-1-oxopropan-2-yl]thio]-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[(2R)-1-(4-methylphenyl)-1-oxopropan-2-yl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[(1R)-2-keto-1-methyl-2-(p-tolyl)ethyl]thio]-4-propyl-1H-1,2,4-triazol-5-one Formula: C15H19N3O2S MolecularWeight: 305.39526

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SC(C)C(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCN1C(=O)NN=C1S[C@H](C)C(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C15H19N3O2S/c1-4-9-18-14(20)16-17-15(18)21-11(3)13(19)12-7-5-10(2)6-8-12/h5-8,11H,4,9H2,1-3H3,(H,16,20)/t11-/m1/s1