(E)-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(3-pyridylmethyl)-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(3-pyridinylmethyl)-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(3-pyridylmethyl)-3-(2-thienyl)acrylamide Formula: C21H17N3OS2 MolecularWeight: 391.50918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)N(CC3=CN=CC=C3)C(=O)C=CC4=CC=CS4

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)N(CC3=CN=CC=C3)C(=O)/C=C/C4=CC=CS4

InChI

InChI=1S/C21H17N3OS2/c1-15-5-2-8-18-20(15)23-21(27-18)24(14-16-6-3-11-22-13-16)19(25)10-9-17-7-4-12-26-17/h2-13H,14H2,1H3/b10-9+