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

Systemtic Name: 2-methyl-3-[(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)amino]cyclopent-2-en-1-one Openeye Name: 2-methyl-3-[(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)amino]cyclopent-2-en-1-one CAS Name: 2-methyl-3-[[3-(methylthio)-1H-1,2,4-triazol-5-yl]amino]-1-cyclopent-2-enone IUPAC Name: 2-methyl-3-[(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)amino]cyclopent-2-en-1-one Traditional Name: 2-methyl-3-[[3-(methylthio)-1H-1,2,4-triazol-5-yl]amino]cyclopent-2-en-1-one Formula: C9H12N4OS MolecularWeight: 224.28278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CCC1=O)NC2=NC(=NN2)SC

Isomeric SMILES

CC1=C(CCC1=O)NC2=NC(=NN2)SC

InChI

InChI=1S/C9H12N4OS/c1-5-6(3-4-7(5)14)10-8-11-9(15-2)13-12-8/h3-4H2,1-2H3,(H2,10,11,12,13)