[2-oxidanylidene-2-(prop-2-enylamino)ethyl] 4-(1,3-benzothiazol-2-yl)butanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylamino)ethyl] 4-(1,3-benzothiazol-2-yl)butanoate Openeye Name: [2-(allylamino)-2-oxo-ethyl] 4-(1,3-benzothiazol-2-yl)butanoate CAS Name: 4-(1,3-benzothiazol-2-yl)butanoic acid [2-oxo-2-(prop-2-enylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylamino)ethyl] 4-(1,3-benzothiazol-2-yl)butanoate Traditional Name: 4-(1,3-benzothiazol-2-yl)butyric acid [2-(allylamino)-2-keto-ethyl] ester Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)COC(=O)CCCC1=NC2=CC=CC=C2S1

Isomeric SMILES

C=CCNC(=O)COC(=O)CCCC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C16H18N2O3S/c1-2-10-17-14(19)11-21-16(20)9-5-8-15-18-12-6-3-4-7-13(12)22-15/h2-4,6-7H,1,5,8-11H2,(H,17,19)