(E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-(6-fluoranyl-1,3-benzothiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-(6-fluoranyl-1,3-benzothiazol-2-yl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-(6-fluoro-1,3-benzothiazol-2-yl)prop-2-enamide CAS Name: (E)-2-cyano-3-(2,5-dimethyl-1-propyl-3-pyrrolyl)-N-(6-fluoro-1,3-benzothiazol-2-yl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(2,5-dimethyl-1-propylpyrrol-3-yl)-N-(6-fluoro-1,3-benzothiazol-2-yl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-(6-fluoro-1,3-benzothiazol-2-yl)acrylamide Formula: C20H19FN4OS MolecularWeight: 382.454463

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C=C(C#N)C(=O)NC2=NC3=C(S2)C=C(C=C3)F)C

Isomeric SMILES

CCCN1C(=CC(=C1C)/C=C(\C#N)/C(=O)NC2=NC3=C(S2)C=C(C=C3)F)C

InChI

InChI=1S/C20H19FN4OS/c1-4-7-25-12(2)8-14(13(25)3)9-15(11-22)19(26)24-20-23-17-6-5-16(21)10-18(17)27-20/h5-6,8-10H,4,7H2,1-3H3,(H,23,24,26)/b15-9+