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

Systemtic Name: (E)-3-[5-(1,3-benzothiazol-2-yl)furan-2-yl]-2-cyano-N-(4-methoxyphenyl)prop-2-enamide Openeye Name: (E)-3-[5-(1,3-benzothiazol-2-yl)-2-furyl]-2-cyano-N-(4-methoxyphenyl)prop-2-enamide CAS Name: (E)-3-[5-(1,3-benzothiazol-2-yl)-2-furanyl]-2-cyano-N-(4-methoxyphenyl)-2-propenamide IUPAC Name: (E)-3-[5-(1,3-benzothiazol-2-yl)furan-2-yl]-2-cyano-N-(4-methoxyphenyl)prop-2-enamide Traditional Name: (E)-3-[5-(1,3-benzothiazol-2-yl)-2-furyl]-2-cyano-N-(4-methoxyphenyl)acrylamide Formula: C22H15N3O3S MolecularWeight: 401.4378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C(=CC2=CC=C(O2)C3=NC4=CC=CC=C4S3)C#N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)/C(=C/C2=CC=C(O2)C3=NC4=CC=CC=C4S3)/C#N

InChI

InChI=1S/C22H15N3O3S/c1-27-16-8-6-15(7-9-16)24-21(26)14(13-23)12-17-10-11-19(28-17)22-25-18-4-2-3-5-20(18)29-22/h2-12H,1H3,(H,24,26)/b14-12+