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

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] 2-(1,3-benzoxazol-2-ylsulfanyl)ethanoate Openeye Name: [2-(butylamino)-2-oxo-ethyl] 2-(1,3-benzoxazol-2-ylsulfanyl)acetate CAS Name: 2-(1,3-benzoxazol-2-ylthio)acetic acid [2-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] 2-(1,3-benzoxazol-2-ylsulfanyl)acetate Traditional Name: 2-(1,3-benzoxazol-2-ylthio)acetic acid [2-(butylamino)-2-keto-ethyl] ester Formula: C15H18N2O4S MolecularWeight: 322.37942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N2O4S/c1-2-3-8-16-13(18)9-20-14(19)10-22-15-17-11-6-4-5-7-12(11)21-15/h4-7H,2-3,8-10H2,1H3,(H,16,18)