3-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-2-methyl-propanenitrile

Systemtic Name: 3-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-2-methyl-propanenitrile Openeye Name: 3-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-2-methyl-propanenitrile CAS Name: 3-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-2-methylpropanenitrile IUPAC Name: 3-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-2-methylpropanenitrile Traditional Name: 3-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-2-methyl-propionitrile Formula: C12H16N4S MolecularWeight: 248.34724

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC1=NN=C(N1C2CC2)C3CC3)C#N

Isomeric SMILES

CC(CSC1=NN=C(N1C2CC2)C3CC3)C#N

InChI

InChI=1S/C12H16N4S/c1-8(6-13)7-17-12-15-14-11(9-2-3-9)16(12)10-4-5-10/h8-10H,2-5,7H2,1H3