[2-(cyclohexylmethylamino)-2-oxidanylidene-ethyl] 2-(1,3-benzoxazol-2-ylsulfanyl)ethanoate

Systemtic Name: [2-(cyclohexylmethylamino)-2-oxidanylidene-ethyl] 2-(1,3-benzoxazol-2-ylsulfanyl)ethanoate Openeye Name: [2-(cyclohexylmethylamino)-2-oxo-ethyl] 2-(1,3-benzoxazol-2-ylsulfanyl)acetate CAS Name: 2-(1,3-benzoxazol-2-ylthio)acetic acid [2-(cyclohexylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclohexylmethylamino)-2-oxoethyl] 2-(1,3-benzoxazol-2-ylsulfanyl)acetate Traditional Name: 2-(1,3-benzoxazol-2-ylthio)acetic acid [2-(cyclohexylmethylamino)-2-keto-ethyl] ester Formula: C18H22N2O4S MolecularWeight: 362.44328

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)COC(=O)CSC2=NC3=CC=CC=C3O2

Isomeric SMILES

C1CCC(CC1)CNC(=O)COC(=O)CSC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C18H22N2O4S/c21-16(19-10-13-6-2-1-3-7-13)11-23-17(22)12-25-18-20-14-8-4-5-9-15(14)24-18/h4-5,8-9,13H,1-3,6-7,10-12H2,(H,19,21)