(E)-3-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)-N-(6-methoxy-1,3-benzothiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)-N-(6-methoxy-1,3-benzothiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-N-(6-methoxy-1,3-benzothiazol-2-yl)prop-2-enamide CAS Name: (E)-3-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-propenamide IUPAC Name: (E)-3-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)-N-(6-methoxy-1,3-benzothiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-(4-benzoxy-3-bromo-5-methoxy-phenyl)-N-(6-methoxy-1,3-benzothiazol-2-yl)acrylamide Formula: C25H21BrN2O4S MolecularWeight: 525.41424

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C=CC3=CC(=C(C(=C3)Br)OCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)/C=C/C3=CC(=C(C(=C3)Br)OCC4=CC=CC=C4)OC

InChI

InChI=1S/C25H21BrN2O4S/c1-30-18-9-10-20-22(14-18)33-25(27-20)28-23(29)11-8-17-12-19(26)24(21(13-17)31-2)32-15-16-6-4-3-5-7-16/h3-14H,15H2,1-2H3,(H,27,28,29)/b11-8+