1-[2-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)carbonyl]pyrazolidin-1-yl]-2-methylsulfanyl-ethanone

Systemtic Name: 1-[2-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)carbonyl]pyrazolidin-1-yl]-2-methylsulfanyl-ethanone Openeye Name: 1-[2-(5-methyl-2-phenyl-triazole-4-carbonyl)pyrazolidin-1-yl]-2-methylsulfanyl-ethanone CAS Name: 1-[2-[(5-methyl-2-phenyl-4-triazolyl)-oxomethyl]-1-pyrazolidinyl]-2-(methylthio)ethanone IUPAC Name: 1-[2-(5-methyl-2-phenyltriazole-4-carbonyl)pyrazolidin-1-yl]-2-methylsulfanylethanone Traditional Name: 1-[2-(5-methyl-2-phenyl-triazole-4-carbonyl)pyrazolidin-1-yl]-2-(methylthio)ethanone Formula: C16H19N5O2S MolecularWeight: 345.41936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)N2CCCN2C(=O)CSC)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(N=C1C(=O)N2CCCN2C(=O)CSC)C3=CC=CC=C3

InChI

InChI=1S/C16H19N5O2S/c1-12-15(18-21(17-12)13-7-4-3-5-8-13)16(23)20-10-6-9-19(20)14(22)11-24-2/h3-5,7-8H,6,9-11H2,1-2H3