methyl 4-[(E)-3-oxidanylidene-3-[(6-phenoxy-1,3-benzothiazol-2-yl)amino]prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-oxidanylidene-3-[(6-phenoxy-1,3-benzothiazol-2-yl)amino]prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-oxo-3-[(6-phenoxy-1,3-benzothiazol-2-yl)amino]prop-1-enyl]benzoate CAS Name: 4-[(E)-3-oxo-3-[(6-phenoxy-1,3-benzothiazol-2-yl)amino]prop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-oxo-3-[(6-phenoxy-1,3-benzothiazol-2-yl)amino]prop-1-enyl]benzoate Traditional Name: 4-[(E)-3-keto-3-[(6-phenoxy-1,3-benzothiazol-2-yl)amino]prop-1-enyl]benzoic acid methyl ester Formula: C24H18N2O4S MolecularWeight: 430.47572

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=CC(=O)NC2=NC3=C(S2)C=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C/C(=O)NC2=NC3=C(S2)C=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C24H18N2O4S/c1-29-23(28)17-10-7-16(8-11-17)9-14-22(27)26-24-25-20-13-12-19(15-21(20)31-24)30-18-5-3-2-4-6-18/h2-15H,1H3,(H,25,26,27)/b14-9+