2-(3-cyclopropyl-1-phenyl-propyl)sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile

Systemtic Name: 2-(3-cyclopropyl-1-phenyl-propyl)sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile Openeye Name: 2-(3-cyclopropyl-1-phenyl-propyl)sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2-[(3-cyclopropyl-1-phenylpropyl)thio]-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-(3-cyclopropyl-1-phenylpropyl)sulfanyl-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 2-[(3-cyclopropyl-1-phenyl-propyl)thio]-4,6-dimethyl-nicotinonitrile Formula: C20H22N2S MolecularWeight: 322.46708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SC(CCC2CC2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SC(CCC2CC2)C3=CC=CC=C3)C

InChI

InChI=1S/C20H22N2S/c1-14-12-15(2)22-20(18(14)13-21)23-19(11-10-16-8-9-16)17-6-4-3-5-7-17/h3-7,12,16,19H,8-11H2,1-2H3