(E)-N-(1,3-benzothiazol-2-yl)-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enamide

Systemtic Name: (E)-N-(1,3-benzothiazol-2-yl)-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enamide Openeye Name: (E)-N-(1,3-benzothiazol-2-yl)-2-cyano-3-(4-isopropylphenyl)prop-2-enamide CAS Name: (E)-N-(1,3-benzothiazol-2-yl)-2-cyano-3-(4-propan-2-ylphenyl)-2-propenamide IUPAC Name: (E)-N-(1,3-benzothiazol-2-yl)-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enamide Traditional Name: (E)-N-(1,3-benzothiazol-2-yl)-2-cyano-3-p-cumenyl-acrylamide Formula: C20H17N3OS MolecularWeight: 347.43348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C20H17N3OS/c1-13(2)15-9-7-14(8-10-15)11-16(12-21)19(24)23-20-22-17-5-3-4-6-18(17)25-20/h3-11,13H,1-2H3,(H,22,23,24)/b16-11+