5,5-dimethyl-3-[(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)amino]cyclohex-2-en-1-one

Systemtic Name: 5,5-dimethyl-3-[(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)amino]cyclohex-2-en-1-one Openeye Name: 5,5-dimethyl-3-[(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)amino]cyclohex-2-en-1-one CAS Name: 5,5-dimethyl-3-[[3-(methylthio)-1H-1,2,4-triazol-5-yl]amino]-1-cyclohex-2-enone IUPAC Name: 5,5-dimethyl-3-[(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)amino]cyclohex-2-en-1-one Traditional Name: 5,5-dimethyl-3-[[3-(methylthio)-1H-1,2,4-triazol-5-yl]amino]cyclohex-2-en-1-one Formula: C11H16N4OS MolecularWeight: 252.33594

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=O)C1)NC2=NC(=NN2)SC)C

Isomeric SMILES

CC1(CC(=CC(=O)C1)NC2=NC(=NN2)SC)C

InChI

InChI=1S/C11H16N4OS/c1-11(2)5-7(4-8(16)6-11)12-9-13-10(17-3)15-14-9/h4H,5-6H2,1-3H3,(H2,12,13,14,15)