6-cyclopropyl-4-(4-methoxyphenyl)-2-(2-oxidanylidenepropylsulfanyl)pyridine-3-carbonitrile

Systemtic Name: 6-cyclopropyl-4-(4-methoxyphenyl)-2-(2-oxidanylidenepropylsulfanyl)pyridine-3-carbonitrile Openeye Name: 2-acetonylsulfanyl-6-cyclopropyl-4-(4-methoxyphenyl)pyridine-3-carbonitrile CAS Name: 6-cyclopropyl-4-(4-methoxyphenyl)-2-(2-oxopropylthio)-3-pyridinecarbonitrile IUPAC Name: 6-cyclopropyl-4-(4-methoxyphenyl)-2-(2-oxopropylsulfanyl)pyridine-3-carbonitrile Traditional Name: 2-(acetonylthio)-6-cyclopropyl-4-(4-methoxyphenyl)nicotinonitrile Formula: C19H18N2O2S MolecularWeight: 338.42342

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=C(C(=CC(=N1)C2CC2)C3=CC=C(C=C3)OC)C#N

Isomeric SMILES

CC(=O)CSC1=C(C(=CC(=N1)C2CC2)C3=CC=C(C=C3)OC)C#N

InChI

InChI=1S/C19H18N2O2S/c1-12(22)11-24-19-17(10-20)16(9-18(21-19)14-3-4-14)13-5-7-15(23-2)8-6-13/h5-9,14H,3-4,11H2,1-2H3