methyl (1Z)-N-[[[2-(1,3-dithiolan-2-yl)phenoxy]carbonyl-methyl-amino]sulfanyl-methyl-carbamoyl]oxyethanimidothioate

Systemtic Name: methyl (1Z)-N-[[[2-(1,3-dithiolan-2-yl)phenoxy]carbonyl-methyl-amino]sulfanyl-methyl-carbamoyl]oxyethanimidothioate Openeye Name: methyl (1Z)-N-[[[2-(1,3-dithiolan-2-yl)phenoxy]carbonyl-methyl-amino]sulfanyl-methyl-carbamoyl]oxyethanimidothioate CAS Name: (1Z)-N-[[[[[[2-(1,3-dithiolan-2-yl)phenoxy]-oxomethyl]-methylamino]thio]-methylamino]-oxomethoxy]ethanimidothioic acid methyl ester IUPAC Name: methyl (1Z)-N-[[[2-(1,3-dithiolan-2-yl)phenoxy]carbonyl-methylamino]sulfanyl-methylcarbamoyl]oxyethanimidothioate Traditional Name: (1Z)-N-[[[[2-(1,3-dithiolan-2-yl)phenoxy]carbonyl-methyl-amino]thio]-methyl-carbamoyl]oxythioacetimidic acid methyl ester Formula: C16H21N3O4S4 MolecularWeight: 447.61564

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC(=O)N(C)SN(C)C(=O)OC1=CC=CC=C1C2SCCS2)SC

Isomeric SMILES

C/C(=N/OC(=O)N(C)SN(C)C(=O)OC1=CC=CC=C1C2SCCS2)/SC

InChI

InChI=1S/C16H21N3O4S4/c1-11(24-4)17-23-16(21)19(3)27-18(2)15(20)22-13-8-6-5-7-12(13)14-25-9-10-26-14/h5-8,14H,9-10H2,1-4H3/b17-11-