2-[3-(3-chlorophenyl)-2-oxidanylidene-propyl]sulfanyl-6-(2-methylpropyl)pyridine-3-carbonitrile

Systemtic Name: 2-[3-(3-chlorophenyl)-2-oxidanylidene-propyl]sulfanyl-6-(2-methylpropyl)pyridine-3-carbonitrile Openeye Name: 2-[3-(3-chlorophenyl)-2-oxo-propyl]sulfanyl-6-isobutyl-pyridine-3-carbonitrile CAS Name: 2-[[3-(3-chlorophenyl)-2-oxopropyl]thio]-6-(2-methylpropyl)-3-pyridinecarbonitrile IUPAC Name: 2-[3-(3-chlorophenyl)-2-oxopropyl]sulfanyl-6-(2-methylpropyl)pyridine-3-carbonitrile Traditional Name: 2-[[3-(3-chlorophenyl)-2-keto-propyl]thio]-6-isobutyl-nicotinonitrile Formula: C19H19ClN2OS MolecularWeight: 358.88496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NC(=C(C=C1)C#N)SCC(=O)CC2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C)CC1=NC(=C(C=C1)C#N)SCC(=O)CC2=CC(=CC=C2)Cl

InChI

InChI=1S/C19H19ClN2OS/c1-13(2)8-17-7-6-15(11-21)19(22-17)24-12-18(23)10-14-4-3-5-16(20)9-14/h3-7,9,13H,8,10,12H2,1-2H3