(E)-N-(1,3-benzothiazol-2-yl)-3-(3-bromanyl-4-methoxy-phenyl)prop-2-enamide

Systemtic Name: (E)-N-(1,3-benzothiazol-2-yl)-3-(3-bromanyl-4-methoxy-phenyl)prop-2-enamide Openeye Name: (E)-N-(1,3-benzothiazol-2-yl)-3-(3-bromo-4-methoxy-phenyl)prop-2-enamide CAS Name: (E)-N-(1,3-benzothiazol-2-yl)-3-(3-bromo-4-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(1,3-benzothiazol-2-yl)-3-(3-bromo-4-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-(1,3-benzothiazol-2-yl)-3-(3-bromo-4-methoxy-phenyl)acrylamide Formula: C17H13BrN2O2S MolecularWeight: 389.26632

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)NC2=NC3=CC=CC=C3S2)Br

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)NC2=NC3=CC=CC=C3S2)Br

InChI

InChI=1S/C17H13BrN2O2S/c1-22-14-8-6-11(10-12(14)18)7-9-16(21)20-17-19-13-4-2-3-5-15(13)23-17/h2-10H,1H3,(H,19,20,21)/b9-7+