(E)-3-[5-(4-bromophenyl)furan-2-yl]-2-cyano-N-(6-methoxy-1,3-benzothiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-3-[5-(4-bromophenyl)furan-2-yl]-2-cyano-N-(6-methoxy-1,3-benzothiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-[5-(4-bromophenyl)-2-furyl]-2-cyano-N-(6-methoxy-1,3-benzothiazol-2-yl)prop-2-enamide CAS Name: (E)-3-[5-(4-bromophenyl)-2-furanyl]-2-cyano-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-propenamide IUPAC Name: (E)-3-[5-(4-bromophenyl)furan-2-yl]-2-cyano-N-(6-methoxy-1,3-benzothiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-[5-(4-bromophenyl)-2-furyl]-2-cyano-N-(6-methoxy-1,3-benzothiazol-2-yl)acrylamide Formula: C22H14BrN3O3S MolecularWeight: 480.33386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C(=CC3=CC=C(O3)C4=CC=C(C=C4)Br)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)/C(=C/C3=CC=C(O3)C4=CC=C(C=C4)Br)/C#N

InChI

InChI=1S/C22H14BrN3O3S/c1-28-16-6-8-18-20(11-16)30-22(25-18)26-21(27)14(12-24)10-17-7-9-19(29-17)13-2-4-15(23)5-3-13/h2-11H,1H3,(H,25,26,27)/b14-10+