(E)-3-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]indol-3-yl]-2-cyano-N-cyclopropyl-prop-2-enamide

Systemtic Name: (E)-3-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]indol-3-yl]-2-cyano-N-cyclopropyl-prop-2-enamide Openeye Name: (E)-3-[1-[(2-chloro-4-fluoro-phenyl)methyl]indol-3-yl]-2-cyano-N-cyclopropyl-prop-2-enamide CAS Name: (E)-3-[1-[(2-chloro-4-fluorophenyl)methyl]-3-indolyl]-2-cyano-N-cyclopropyl-2-propenamide IUPAC Name: (E)-3-[1-[(2-chloro-4-fluorophenyl)methyl]indol-3-yl]-2-cyano-N-cyclopropylprop-2-enamide Traditional Name: (E)-3-[1-(2-chloro-4-fluoro-benzyl)indol-3-yl]-2-cyano-N-cyclopropyl-acrylamide Formula: C22H17ClFN3O MolecularWeight: 393.841283

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C(=CC2=CN(C3=CC=CC=C32)CC4=C(C=C(C=C4)F)Cl)C#N

Isomeric SMILES

C1CC1NC(=O)/C(=C/C2=CN(C3=CC=CC=C32)CC4=C(C=C(C=C4)F)Cl)/C#N

InChI

InChI=1S/C22H17ClFN3O/c23-20-10-17(24)6-5-14(20)12-27-13-16(19-3-1-2-4-21(19)27)9-15(11-25)22(28)26-18-7-8-18/h1-6,9-10,13,18H,7-8,12H2,(H,26,28)/b15-9+