methyl 2-[[5,5-dimethyl-2-(2-propan-2-ylphenyl)imino-1,3-thiazinan-3-yl]carbothioylsulfanyl]propanoate

Systemtic Name: methyl 2-[[5,5-dimethyl-2-(2-propan-2-ylphenyl)imino-1,3-thiazinan-3-yl]carbothioylsulfanyl]propanoate Openeye Name: methyl 2-[2-(2-isopropylphenyl)imino-5,5-dimethyl-1,3-thiazinane-3-carbothioyl]sulfanylpropanoate CAS Name: 2-[[[5,5-dimethyl-2-(2-propan-2-ylphenyl)imino-1,3-thiazinan-3-yl]-sulfanylidenemethyl]thio]propanoic acid methyl ester IUPAC Name: methyl 2-[5,5-dimethyl-2-(2-propan-2-ylphenyl)imino-1,3-thiazinane-3-carbothioyl]sulfanylpropanoate Traditional Name: 2-[(5,5-dimethyl-2-o-cumenylimino-1,3-thiazinane-3-carbothioyl)thio]propionic acid methyl ester Formula: C20H28N2O2S3 MolecularWeight: 424.64352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N=C2N(CC(CS2)(C)C)C(=S)SC(C)C(=O)OC

Isomeric SMILES

CC(C)C1=CC=CC=C1N=C2N(CC(CS2)(C)C)C(=S)SC(C)C(=O)OC

InChI

InChI=1S/C20H28N2O2S3/c1-13(2)15-9-7-8-10-16(15)21-18-22(11-20(4,5)12-26-18)19(25)27-14(3)17(23)24-6/h7-10,13-14H,11-12H2,1-6H3