2-[(6-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-4-methyl-6-oxidanylidene-1H-pyridine-3-carbonitrile

Systemtic Name: 2-[(6-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-4-methyl-6-oxidanylidene-1H-pyridine-3-carbonitrile Openeye Name: 2-[(6-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-4-methyl-6-oxo-1H-pyridine-3-carbonitrile CAS Name: 2-[(6-chloro-1,3-benzodioxol-5-yl)methylthio]-4-methyl-6-oxo-1H-pyridine-3-carbonitrile IUPAC Name: 2-[(6-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-4-methyl-6-oxo-1H-pyridine-3-carbonitrile Traditional Name: 2-[(6-chloro-1,3-benzodioxol-5-yl)methylthio]-6-keto-4-methyl-1H-pyridine-3-carbonitrile Formula: C15H11ClN2O3S MolecularWeight: 334.77744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)NC(=C1C#N)SCC2=CC3=C(C=C2Cl)OCO3

Isomeric SMILES

CC1=CC(=O)NC(=C1C#N)SCC2=CC3=C(C=C2Cl)OCO3

InChI

InChI=1S/C15H11ClN2O3S/c1-8-2-14(19)18-15(10(8)5-17)22-6-9-3-12-13(4-11(9)16)21-7-20-12/h2-4H,6-7H2,1H3,(H,18,19)