methyl 4-[(E)-3-(1,3-benzothiazol-2-ylamino)-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-(1,3-benzothiazol-2-ylamino)-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-(1,3-benzothiazol-2-ylamino)-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-(1,3-benzothiazol-2-ylamino)-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-(1,3-benzothiazol-2-ylamino)-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-(1,3-benzothiazol-2-ylamino)-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C18H14N2O3S MolecularWeight: 338.38036

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=CC(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C/C(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H14N2O3S/c1-23-17(22)13-9-6-12(7-10-13)8-11-16(21)20-18-19-14-4-2-3-5-15(14)24-18/h2-11H,1H3,(H,19,20,21)/b11-8+