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

Systemtic Name: [2-oxidanylidene-2-(pentylamino)ethyl] 2-(1,3-benzoxazol-2-ylsulfanyl)ethanoate Openeye Name: [2-oxo-2-(pentylamino)ethyl] 2-(1,3-benzoxazol-2-ylsulfanyl)acetate CAS Name: 2-(1,3-benzoxazol-2-ylthio)acetic acid [2-oxo-2-(pentylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentylamino)ethyl] 2-(1,3-benzoxazol-2-ylsulfanyl)acetate Traditional Name: 2-(1,3-benzoxazol-2-ylthio)acetic acid [2-(amylamino)-2-keto-ethyl] ester Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)COC(=O)CSC1=NC2=CC=CC=C2O1

Isomeric SMILES

CCCCCNC(=O)COC(=O)CSC1=NC2=CC=CC=C2O1

InChI

InChI=1S/C16H20N2O4S/c1-2-3-6-9-17-14(19)10-21-15(20)11-23-16-18-12-7-4-5-8-13(12)22-16/h4-5,7-8H,2-3,6,9-11H2,1H3,(H,17,19)