(E)-3-(4-butoxyphenyl)-2-cyano-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]prop-2-enamide

Systemtic Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]prop-2-enamide Openeye Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]prop-2-enamide CAS Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-propenamide IUPAC Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]prop-2-enamide Traditional Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acrylamide Formula: C28H25N3O2S MolecularWeight: 467.582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)C3=NC4=C(S3)C=C(C=C4)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)C3=NC4=C(S3)C=C(C=C4)C

InChI

InChI=1S/C28H25N3O2S/c1-3-4-15-33-24-12-6-20(7-13-24)17-22(18-29)27(32)30-23-10-8-21(9-11-23)28-31-25-14-5-19(2)16-26(25)34-28/h5-14,16-17H,3-4,15H2,1-2H3,(H,30,32)/b22-17+