N-benzo[e][1,3]benzothiazol-2-yl-2-cyano-3-phenyl-prop-2-enamide

Systemtic Name: N-benzo[e][1,3]benzothiazol-2-yl-2-cyano-3-phenyl-prop-2-enamide Openeye Name: N-benzo[e][1,3]benzothiazol-2-yl-2-cyano-3-phenyl-prop-2-enamide CAS Name: N-(2-benzo[e][1,3]benzothiazolyl)-2-cyano-3-phenyl-2-propenamide IUPAC Name: N-benzo[e][1,3]benzothiazol-2-yl-2-cyano-3-phenylprop-2-enamide Traditional Name: N-benzo[e][1,3]benzothiazol-2-yl-2-cyano-3-phenyl-acrylamide Formula: C21H13N3OS MolecularWeight: 355.41242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43

InChI

InChI=1S/C21H13N3OS/c22-13-16(12-14-6-2-1-3-7-14)20(25)24-21-23-19-17-9-5-4-8-15(17)10-11-18(19)26-21/h1-12H,(H,23,24,25)