(E)-N-(1,3-benzothiazol-2-yl)-2-cyano-3-(2,5-dimethyl-1H-indol-3-yl)prop-2-enamide

Systemtic Name: (E)-N-(1,3-benzothiazol-2-yl)-2-cyano-3-(2,5-dimethyl-1H-indol-3-yl)prop-2-enamide Openeye Name: (E)-N-(1,3-benzothiazol-2-yl)-2-cyano-3-(2,5-dimethyl-1H-indol-3-yl)prop-2-enamide CAS Name: (E)-N-(1,3-benzothiazol-2-yl)-2-cyano-3-(2,5-dimethyl-1H-indol-3-yl)-2-propenamide IUPAC Name: (E)-N-(1,3-benzothiazol-2-yl)-2-cyano-3-(2,5-dimethyl-1H-indol-3-yl)prop-2-enamide Traditional Name: (E)-N-(1,3-benzothiazol-2-yl)-2-cyano-3-(2,5-dimethyl-1H-indol-3-yl)acrylamide Formula: C21H16N4OS MolecularWeight: 372.44294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2C=C(C#N)C(=O)NC3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2/C=C(\C#N)/C(=O)NC3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C21H16N4OS/c1-12-7-8-17-16(9-12)15(13(2)23-17)10-14(11-22)20(26)25-21-24-18-5-3-4-6-19(18)27-21/h3-10,23H,1-2H3,(H,24,25,26)/b14-10+