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

Systemtic Name: methyl 4-[(E)-3-[1,3-benzothiazol-2-yl(phenyl)amino]-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-[N-(1,3-benzothiazol-2-yl)anilino]-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-[N-(1,3-benzothiazol-2-yl)anilino]-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-[N-(1,3-benzothiazol-2-yl)anilino]-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-[N-(1,3-benzothiazol-2-yl)anilino]-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C24H18N2O3S MolecularWeight: 414.47632

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=CC(=O)N(C2=CC=CC=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C/C(=O)N(C2=CC=CC=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H18N2O3S/c1-29-23(28)18-14-11-17(12-15-18)13-16-22(27)26(19-7-3-2-4-8-19)24-25-20-9-5-6-10-21(20)30-24/h2-16H,1H3/b16-13+