4-(6-methyl-4-oxidanylidene-5-phenylsulfanyl-2,3-dihydropyran-2-yl)benzenecarbonitrile

Systemtic Name: 4-(6-methyl-4-oxidanylidene-5-phenylsulfanyl-2,3-dihydropyran-2-yl)benzenecarbonitrile Openeye Name: 4-(6-methyl-4-oxo-5-phenylsulfanyl-2,3-dihydropyran-2-yl)benzonitrile CAS Name: 4-[6-methyl-4-oxo-5-(phenylthio)-2,3-dihydropyran-2-yl]benzonitrile IUPAC Name: 4-(6-methyl-4-oxo-5-phenylsulfanyl-2,3-dihydropyran-2-yl)benzonitrile Traditional Name: 4-[4-keto-6-methyl-5-(phenylthio)-2,3-dihydropyran-2-yl]benzonitrile Formula: C19H15NO2S MolecularWeight: 321.3929

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)CC(O1)C2=CC=C(C=C2)C#N)SC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)CC(O1)C2=CC=C(C=C2)C#N)SC3=CC=CC=C3

InChI

InChI=1S/C19H15NO2S/c1-13-19(23-16-5-3-2-4-6-16)17(21)11-18(22-13)15-9-7-14(12-20)8-10-15/h2-10,18H,11H2,1H3