2-methyl-2-[3-propan-2-yl-5-(1,2,4-triazol-1-ylmethyl)phenyl]propanenitrile

Systemtic Name: 2-methyl-2-[3-propan-2-yl-5-(1,2,4-triazol-1-ylmethyl)phenyl]propanenitrile Openeye Name: 2-[3-isopropyl-5-(1,2,4-triazol-1-ylmethyl)phenyl]-2-methyl-propanenitrile CAS Name: 2-methyl-2-[3-propan-2-yl-5-(1,2,4-triazol-1-ylmethyl)phenyl]propanenitrile IUPAC Name: 2-methyl-2-[3-propan-2-yl-5-(1,2,4-triazol-1-ylmethyl)phenyl]propanenitrile Traditional Name: 2-[3-isopropyl-5-(1,2,4-triazol-1-ylmethyl)phenyl]-2-methyl-propionitrile Formula: C16H20N4 MolecularWeight: 268.3568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC(=C1)CN2C=NC=N2)C(C)(C)C#N

Isomeric SMILES

CC(C)C1=CC(=CC(=C1)CN2C=NC=N2)C(C)(C)C#N

InChI

InChI=1S/C16H20N4/c1-12(2)14-5-13(8-20-11-18-10-19-20)6-15(7-14)16(3,4)9-17/h5-7,10-12H,8H2,1-4H3