2-[5-(4-methylphenyl)-2-oxidanylidene-6H-1,3,4-thiadiazin-3-yl]ethanenitrile

Systemtic Name: 2-[5-(4-methylphenyl)-2-oxidanylidene-6H-1,3,4-thiadiazin-3-yl]ethanenitrile Openeye Name: 2-[2-oxo-5-(p-tolyl)-6H-1,3,4-thiadiazin-3-yl]acetonitrile CAS Name: 2-[5-(4-methylphenyl)-2-oxo-6H-1,3,4-thiadiazin-3-yl]acetonitrile IUPAC Name: 2-[5-(4-methylphenyl)-2-oxo-6H-1,3,4-thiadiazin-3-yl]acetonitrile Traditional Name: 2-[2-keto-5-(p-tolyl)-6H-1,3,4-thiadiazin-3-yl]acetonitrile Formula: C12H11N3OS MolecularWeight: 245.30024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)SC2)CC#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)SC2)CC#N

InChI

InChI=1S/C12H11N3OS/c1-9-2-4-10(5-3-9)11-8-17-12(16)15(14-11)7-6-13/h2-5H,7-8H2,1H3