(E)-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-benzyl-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-benzyl-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-benzyl-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-3-(2-thienyl)acrylamide Formula: C23H20N2OS2 MolecularWeight: 404.5477

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)C=CC4=CC=CS4)C

Isomeric SMILES

CC1=C(C2=C(C=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)/C=C/C4=CC=CS4)C

InChI

InChI=1S/C23H20N2OS2/c1-16-10-12-20-22(17(16)2)24-23(28-20)25(15-18-7-4-3-5-8-18)21(26)13-11-19-9-6-14-27-19/h3-14H,15H2,1-2H3/b13-11+