S-methyl N-[(1S,2R)-2-(iodanylmethyl)cyclohexyl]carbamothioate

Systemtic Name: S-methyl N-[(1S,2R)-2-(iodanylmethyl)cyclohexyl]carbamothioate Openeye Name: S-methyl N-[(1S,2R)-2-(iodomethyl)cyclohexyl]carbamothioate CAS Name: N-[(1S,2R)-2-(iodomethyl)cyclohexyl]carbamothioic acid S-methyl ester IUPAC Name: S-methyl N-[(1S,2R)-2-(iodomethyl)cyclohexyl]carbamothioate Traditional Name: N-[(1S,2R)-2-(iodomethyl)cyclohexyl]thiocarbamic acid S-methyl ester Formula: C9H16INOS MolecularWeight: 313.19891

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=O)NC1CCCCC1CI

Isomeric SMILES

CSC(=O)N[C@H]1CCCC[C@H]1CI

InChI

InChI=1S/C9H16INOS/c1-13-9(12)11-8-5-3-2-4-7(8)6-10/h7-8H,2-6H2,1H3,(H,11,12)/t7-,8-/m0/s1