(E)-N-(1,3-benzothiazol-2-ylmethyl)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]-N-methyl-prop-2-enamide

Systemtic Name: (E)-N-(1,3-benzothiazol-2-ylmethyl)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]-N-methyl-prop-2-enamide Openeye Name: (E)-N-(1,3-benzothiazol-2-ylmethyl)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]-N-methyl-prop-2-enamide CAS Name: (E)-N-(1,3-benzothiazol-2-ylmethyl)-3-[4-(cyanomethoxy)-3-methoxyphenyl]-N-methyl-2-propenamide IUPAC Name: (E)-N-(1,3-benzothiazol-2-ylmethyl)-3-[4-(cyanomethoxy)-3-methoxyphenyl]-N-methylprop-2-enamide Traditional Name: (E)-N-(1,3-benzothiazol-2-ylmethyl)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]-N-methyl-acrylamide Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C(=O)C=CC3=CC(=C(C=C3)OCC#N)OC

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C(=O)/C=C/C3=CC(=C(C=C3)OCC#N)OC

InChI

InChI=1S/C21H19N3O3S/c1-24(14-20-23-16-5-3-4-6-19(16)28-20)21(25)10-8-15-7-9-17(27-12-11-22)18(13-15)26-2/h3-10,13H,12,14H2,1-2H3/b10-8+