methyl 3-[5-[(E)-3-(1,3-benzothiazol-2-ylamino)-3-oxidanylidene-prop-1-enyl]furan-2-yl]propanoate

Systemtic Name: methyl 3-[5-[(E)-3-(1,3-benzothiazol-2-ylamino)-3-oxidanylidene-prop-1-enyl]furan-2-yl]propanoate Openeye Name: methyl 3-[5-[(E)-3-(1,3-benzothiazol-2-ylamino)-3-oxo-prop-1-enyl]-2-furyl]propanoate CAS Name: 3-[5-[(E)-3-(1,3-benzothiazol-2-ylamino)-3-oxoprop-1-enyl]-2-furanyl]propanoic acid methyl ester IUPAC Name: methyl 3-[5-[(E)-3-(1,3-benzothiazol-2-ylamino)-3-oxoprop-1-enyl]furan-2-yl]propanoate Traditional Name: 3-[5-[(E)-3-(1,3-benzothiazol-2-ylamino)-3-keto-prop-1-enyl]-2-furyl]propionic acid methyl ester Formula: C18H16N2O4S MolecularWeight: 356.39564

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(O1)C=CC(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC(=O)CCC1=CC=C(O1)/C=C/C(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H16N2O4S/c1-23-17(22)11-9-13-7-6-12(24-13)8-10-16(21)20-18-19-14-4-2-3-5-15(14)25-18/h2-8,10H,9,11H2,1H3,(H,19,20,21)/b10-8+