3-methyl-1-phenyl-5-([1,2,4]triazolo[1,5-a]pyrimidin-2-ylsulfanylmethyl)pyrazole-4-carbonitrile

Systemtic Name: 3-methyl-1-phenyl-5-([1,2,4]triazolo[1,5-a]pyrimidin-2-ylsulfanylmethyl)pyrazole-4-carbonitrile Openeye Name: 3-methyl-1-phenyl-5-([1,2,4]triazolo[1,5-a]pyrimidin-2-ylsulfanylmethyl)pyrazole-4-carbonitrile CAS Name: 3-methyl-1-phenyl-5-[([1,2,4]triazolo[1,5-a]pyrimidin-2-ylthio)methyl]-4-pyrazolecarbonitrile IUPAC Name: 3-methyl-1-phenyl-5-([1,2,4]triazolo[1,5-a]pyrimidin-2-ylsulfanylmethyl)pyrazole-4-carbonitrile Traditional Name: 3-methyl-1-phenyl-5-[([1,2,4]triazolo[1,5-a]pyrimidin-2-ylthio)methyl]pyrazole-4-carbonitrile Formula: C17H13N7S MolecularWeight: 347.39702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)CSC2=NN3C=CC=NC3=N2)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C#N)CSC2=NN3C=CC=NC3=N2)C4=CC=CC=C4

InChI

InChI=1S/C17H13N7S/c1-12-14(10-18)15(24(21-12)13-6-3-2-4-7-13)11-25-17-20-16-19-8-5-9-23(16)22-17/h2-9H,11H2,1H3