N-(1,3-benzothiazol-2-yl)-2-cyano-3-[1-(phenylmethyl)indol-3-yl]prop-2-enamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-cyano-3-[1-(phenylmethyl)indol-3-yl]prop-2-enamide Openeye Name: N-(1,3-benzothiazol-2-yl)-3-(1-benzylindol-3-yl)-2-cyano-prop-2-enamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-cyano-3-[1-(phenylmethyl)-3-indolyl]-2-propenamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-3-(1-benzylindol-3-yl)-2-cyanoprop-2-enamide Traditional Name: N-(1,3-benzothiazol-2-yl)-3-(1-benzylindol-3-yl)-2-cyano-acrylamide Formula: C26H18N4OS MolecularWeight: 434.51232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)C=C(C#N)C(=O)NC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)C=C(C#N)C(=O)NC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H18N4OS/c27-15-19(25(31)29-26-28-22-11-5-7-13-24(22)32-26)14-20-17-30(16-18-8-2-1-3-9-18)23-12-6-4-10-21(20)23/h1-14,17H,16H2,(H,28,29,31)