(E)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-phenyl-N-(phenylmethyl)prop-2-enamide

Systemtic Name: (E)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-phenyl-N-(phenylmethyl)prop-2-enamide Openeye Name: (E)-N-benzyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-phenyl-prop-2-enamide CAS Name: (E)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-phenyl-N-(phenylmethyl)-2-propenamide IUPAC Name: (E)-N-benzyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-phenylprop-2-enamide Traditional Name: (E)-N-benzyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-phenyl-acrylamide Formula: C25H22N2OS MolecularWeight: 398.51998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)C=CC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)/C=C/C4=CC=CC=C4)C

InChI

InChI=1S/C25H22N2OS/c1-18-15-19(2)24-22(16-18)29-25(26-24)27(17-21-11-7-4-8-12-21)23(28)14-13-20-9-5-3-6-10-20/h3-16H,17H2,1-2H3/b14-13+