[2-[2-(furan-2-ylcarbonyl)hydrazinyl]-2-oxidanylidene-ethyl] 4-(1,3-benzothiazol-2-yl)butanoate

Systemtic Name: [2-[2-(furan-2-ylcarbonyl)hydrazinyl]-2-oxidanylidene-ethyl] 4-(1,3-benzothiazol-2-yl)butanoate Openeye Name: [2-[2-(furan-2-carbonyl)hydrazino]-2-oxo-ethyl] 4-(1,3-benzothiazol-2-yl)butanoate CAS Name: 4-(1,3-benzothiazol-2-yl)butanoic acid [2-[[2-furanyl(oxo)methyl]hydrazo]-2-oxoethyl] ester IUPAC Name: [2-[2-(furan-2-carbonyl)hydrazinyl]-2-oxoethyl] 4-(1,3-benzothiazol-2-yl)butanoate Traditional Name: 4-(1,3-benzothiazol-2-yl)butyric acid [2-[N'-(2-furoyl)hydrazino]-2-keto-ethyl] ester Formula: C18H17N3O5S MolecularWeight: 387.40968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CCCC(=O)OCC(=O)NNC(=O)C3=CC=CO3

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CCCC(=O)OCC(=O)NNC(=O)C3=CC=CO3

InChI

InChI=1S/C18H17N3O5S/c22-15(20-21-18(24)13-6-4-10-25-13)11-26-17(23)9-3-8-16-19-12-5-1-2-7-14(12)27-16/h1-2,4-7,10H,3,8-9,11H2,(H,20,22)(H,21,24)