ethyl 2-(1,3-benzoxazol-2-ylamino)-4-methylsulfanyl-butanoate

Systemtic Name: ethyl 2-(1,3-benzoxazol-2-ylamino)-4-methylsulfanyl-butanoate Openeye Name: ethyl 2-(1,3-benzoxazol-2-ylamino)-4-methylsulfanyl-butanoate CAS Name: 2-(1,3-benzoxazol-2-ylamino)-4-(methylthio)butanoic acid ethyl ester IUPAC Name: ethyl 2-(1,3-benzoxazol-2-ylamino)-4-methylsulfanylbutanoate Traditional Name: 2-(1,3-benzoxazol-2-ylamino)-4-(methylthio)butyric acid ethyl ester Formula: C14H18N2O3S MolecularWeight: 294.36932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCSC)NC1=NC2=CC=CC=C2O1

Isomeric SMILES

CCOC(=O)C(CCSC)NC1=NC2=CC=CC=C2O1

InChI

InChI=1S/C14H18N2O3S/c1-3-18-13(17)11(8-9-20-2)16-14-15-10-6-4-5-7-12(10)19-14/h4-7,11H,3,8-9H2,1-2H3,(H,15,16)