S-[2-[2-cyclohexylethyl-[[2-(2-hydroxyethylamino)-2-oxidanylidene-ethyl]carbamoyl]amino]ethyl] ethanethioate

Systemtic Name: S-[2-[2-cyclohexylethyl-[[2-(2-hydroxyethylamino)-2-oxidanylidene-ethyl]carbamoyl]amino]ethyl] ethanethioate Openeye Name: S-[2-[2-cyclohexylethyl-[[2-(2-hydroxyethylamino)-2-oxo-ethyl]carbamoyl]amino]ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[2-cyclohexylethyl-[[[2-(2-hydroxyethylamino)-2-oxoethyl]amino]-oxomethyl]amino]ethyl] ester IUPAC Name: S-[2-[2-cyclohexylethyl-[[2-(2-hydroxyethylamino)-2-oxoethyl]carbamoyl]amino]ethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[2-cyclohexylethyl-[[2-(2-hydroxyethylamino)-2-keto-ethyl]carbamoyl]amino]ethyl] ester Formula: C17H31N3O4S MolecularWeight: 373.51074

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCN(CCC1CCCCC1)C(=O)NCC(=O)NCCO

Isomeric SMILES

CC(=O)SCCN(CCC1CCCCC1)C(=O)NCC(=O)NCCO

InChI

InChI=1S/C17H31N3O4S/c1-14(22)25-12-10-20(9-7-15-5-3-2-4-6-15)17(24)19-13-16(23)18-8-11-21/h15,21H,2-13H2,1H3,(H,18,23)(H,19,24)