[2-[(6-bromanyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl] 3-(furan-2-yl)propanoate

Systemtic Name: [2-[(6-bromanyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl] 3-(furan-2-yl)propanoate Openeye Name: [2-[(6-bromo-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl] 3-(2-furyl)propanoate CAS Name: 3-(2-furanyl)propanoic acid [2-[(6-bromo-1,3-benzothiazol-2-yl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(6-bromo-1,3-benzothiazol-2-yl)amino]-2-oxoethyl] 3-(furan-2-yl)propanoate Traditional Name: 3-(2-furyl)propionic acid [2-[(6-bromo-1,3-benzothiazol-2-yl)amino]-2-keto-ethyl] ester Formula: C16H13BrN2O4S MolecularWeight: 409.25442

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CCC(=O)OCC(=O)NC2=NC3=C(S2)C=C(C=C3)Br

Isomeric SMILES

C1=COC(=C1)CCC(=O)OCC(=O)NC2=NC3=C(S2)C=C(C=C3)Br

InChI

InChI=1S/C16H13BrN2O4S/c17-10-3-5-12-13(8-10)24-16(18-12)19-14(20)9-23-15(21)6-4-11-2-1-7-22-11/h1-3,5,7-8H,4,6,9H2,(H,18,19,20)