ethyl 2-[[5,5-diethyl-2-(2-propan-2-ylphenyl)imino-1,3-thiazinan-3-yl]carbothioylsulfanyl]ethanoate

Systemtic Name: ethyl 2-[[5,5-diethyl-2-(2-propan-2-ylphenyl)imino-1,3-thiazinan-3-yl]carbothioylsulfanyl]ethanoate Openeye Name: ethyl 2-[5,5-diethyl-2-(2-isopropylphenyl)imino-1,3-thiazinane-3-carbothioyl]sulfanylacetate CAS Name: 2-[[[5,5-diethyl-2-(2-propan-2-ylphenyl)imino-1,3-thiazinan-3-yl]-sulfanylidenemethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[5,5-diethyl-2-(2-propan-2-ylphenyl)imino-1,3-thiazinane-3-carbothioyl]sulfanylacetate Traditional Name: 2-[(5,5-diethyl-2-o-cumenylimino-1,3-thiazinane-3-carbothioyl)thio]acetic acid ethyl ester Formula: C22H32N2O2S3 MolecularWeight: 452.69668

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CN(C(=NC2=CC=CC=C2C(C)C)SC1)C(=S)SCC(=O)OCC)CC

Isomeric SMILES

CCC1(CN(C(=NC2=CC=CC=C2C(C)C)SC1)C(=S)SCC(=O)OCC)CC

InChI

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