ethyl 4-[3-(1,3-benzothiazol-2-yl)propanoylamino]butanoate

Systemtic Name: ethyl 4-[3-(1,3-benzothiazol-2-yl)propanoylamino]butanoate Openeye Name: ethyl 4-[3-(1,3-benzothiazol-2-yl)propanoylamino]butanoate CAS Name: 4-[[3-(1,3-benzothiazol-2-yl)-1-oxopropyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[3-(1,3-benzothiazol-2-yl)propanoylamino]butanoate Traditional Name: 4-[3-(1,3-benzothiazol-2-yl)propanoylamino]butyric acid ethyl ester Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC(=O)CCC1=NC2=CC=CC=C2S1

Isomeric SMILES

CCOC(=O)CCCNC(=O)CCC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C16H20N2O3S/c1-2-21-16(20)8-5-11-17-14(19)9-10-15-18-12-6-3-4-7-13(12)22-15/h3-4,6-7H,2,5,8-11H2,1H3,(H,17,19)