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

Systemtic Name: ethyl 2-[[5,5-dimethyl-2-(2-propan-2-ylphenyl)imino-1,3-thiazinan-3-yl]carbothioylsulfanyl]-2-methyl-propanoate Openeye Name: ethyl 2-[2-(2-isopropylphenyl)imino-5,5-dimethyl-1,3-thiazinane-3-carbothioyl]sulfanyl-2-methyl-propanoate CAS Name: 2-[[[5,5-dimethyl-2-(2-propan-2-ylphenyl)imino-1,3-thiazinan-3-yl]-sulfanylidenemethyl]thio]-2-methylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[5,5-dimethyl-2-(2-propan-2-ylphenyl)imino-1,3-thiazinane-3-carbothioyl]sulfanyl-2-methylpropanoate Traditional Name: 2-[(5,5-dimethyl-2-o-cumenylimino-1,3-thiazinane-3-carbothioyl)thio]-2-methyl-propionic acid ethyl ester Formula: C22H32N2O2S3 MolecularWeight: 452.69668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)SC(=S)N1CC(CSC1=NC2=CC=CC=C2C(C)C)(C)C

Isomeric SMILES

CCOC(=O)C(C)(C)SC(=S)N1CC(CSC1=NC2=CC=CC=C2C(C)C)(C)C

InChI

InChI=1S/C22H32N2O2S3/c1-8-26-18(25)22(6,7)29-20(27)24-13-21(4,5)14-28-19(24)23-17-12-10-9-11-16(17)15(2)3/h9-12,15H,8,13-14H2,1-7H3