S-[(10-aminocarbonyl-2-oxidanylidene-azecan-3-yl)methyl] ethanethioate

Systemtic Name: S-[(10-aminocarbonyl-2-oxidanylidene-azecan-3-yl)methyl] ethanethioate Openeye Name: S-[(10-carbamoyl-2-oxo-azecan-3-yl)methyl] ethanethioate CAS Name: ethanethioic acid S-[(10-carbamoyl-2-oxo-3-azecanyl)methyl] ester IUPAC Name: S-[(10-carbamoyl-2-oxoazecan-3-yl)methyl] ethanethioate Traditional Name: ethanethioic acid S-[(10-carbamoyl-2-keto-azecan-3-yl)methyl] ester Formula: C13H22N2O3S MolecularWeight: 286.39038

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1CCCCCCC(NC1=O)C(=O)N

Isomeric SMILES

CC(=O)SCC1CCCCCCC(NC1=O)C(=O)N

InChI

InChI=1S/C13H22N2O3S/c1-9(16)19-8-10-6-4-2-3-5-7-11(12(14)17)15-13(10)18/h10-11H,2-8H2,1H3,(H2,14,17)(H,15,18)