5-methyl-3-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-1,2-thiazole-4-carbonitrile

Systemtic Name: 5-methyl-3-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-1,2-thiazole-4-carbonitrile Openeye Name: 5-methyl-3-[2-oxo-2-(p-tolyl)ethyl]sulfanyl-isothiazole-4-carbonitrile CAS Name: 5-methyl-3-[[2-(4-methylphenyl)-2-oxoethyl]thio]-4-isothiazolecarbonitrile IUPAC Name: 5-methyl-3-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-1,2-thiazole-4-carbonitrile Traditional Name: 3-[[2-keto-2-(p-tolyl)ethyl]thio]-5-methyl-isothiazole-4-carbonitrile Formula: C14H12N2OS2 MolecularWeight: 288.38788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NSC(=C2C#N)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NSC(=C2C#N)C

InChI

InChI=1S/C14H12N2OS2/c1-9-3-5-11(6-4-9)13(17)8-18-14-12(7-15)10(2)19-16-14/h3-6H,8H2,1-2H3