tert-butyl 2-[[5,5-diethyl-2-(2-methoxyphenyl)imino-1,3-thiazinan-3-yl]carbothioylsulfanyl]ethanoate

Systemtic Name: tert-butyl 2-[[5,5-diethyl-2-(2-methoxyphenyl)imino-1,3-thiazinan-3-yl]carbothioylsulfanyl]ethanoate Openeye Name: tert-butyl 2-[5,5-diethyl-2-(2-methoxyphenyl)imino-1,3-thiazinane-3-carbothioyl]sulfanylacetate CAS Name: 2-[[[5,5-diethyl-2-(2-methoxyphenyl)imino-1,3-thiazinan-3-yl]-sulfanylidenemethyl]thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[5,5-diethyl-2-(2-methoxyphenyl)imino-1,3-thiazinane-3-carbothioyl]sulfanylacetate Traditional Name: 2-[[5,5-diethyl-2-(2-methoxyphenyl)imino-1,3-thiazinane-3-carbothioyl]thio]acetic acid tert-butyl ester Formula: C22H32N2O3S3 MolecularWeight: 468.69608

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CN(C(=NC2=CC=CC=C2OC)SC1)C(=S)SCC(=O)OC(C)(C)C)CC

Isomeric SMILES

CCC1(CN(C(=NC2=CC=CC=C2OC)SC1)C(=S)SCC(=O)OC(C)(C)C)CC

InChI

InChI=1S/C22H32N2O3S3/c1-7-22(8-2)14-24(20(28)29-13-18(25)27-21(3,4)5)19(30-15-22)23-16-11-9-10-12-17(16)26-6/h9-12H,7-8,13-15H2,1-6H3