2-(2-methyl-8-propan-2-yl-quinolin-4-yl)sulfanylethanenitrile

Systemtic Name: 2-(2-methyl-8-propan-2-yl-quinolin-4-yl)sulfanylethanenitrile Openeye Name: 2-[(8-isopropyl-2-methyl-4-quinolyl)sulfanyl]acetonitrile CAS Name: 2-[(2-methyl-8-propan-2-yl-4-quinolinyl)thio]acetonitrile IUPAC Name: 2-(2-methyl-8-propan-2-ylquinolin-4-yl)sulfanylacetonitrile Traditional Name: 2-[(8-isopropyl-2-methyl-4-quinolyl)thio]acetonitrile Formula: C15H16N2S MolecularWeight: 256.36594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2C(C)C)C(=C1)SCC#N

Isomeric SMILES

CC1=NC2=C(C=CC=C2C(C)C)C(=C1)SCC#N

InChI

InChI=1S/C15H16N2S/c1-10(2)12-5-4-6-13-14(18-8-7-16)9-11(3)17-15(12)13/h4-6,9-10H,8H2,1-3H3