4-[4-chloranyl-2-(3-methyl-1H-benzimidazol-2-ylidene)-7-(trifluoromethyl)indol-3-yl]butan-1-amine

Systemtic Name: 4-[4-chloranyl-2-(3-methyl-1H-benzimidazol-2-ylidene)-7-(trifluoromethyl)indol-3-yl]butan-1-amine Openeye Name: 4-[4-chloro-2-(3-methyl-1H-benzimidazol-2-ylidene)-7-(trifluoromethyl)indol-3-yl]butan-1-amine CAS Name: 4-[4-chloro-2-(3-methyl-1H-benzimidazol-2-ylidene)-7-(trifluoromethyl)-3-indolyl]-1-butanamine IUPAC Name: 4-[4-chloro-2-(3-methyl-1H-benzimidazol-2-ylidene)-7-(trifluoromethyl)indol-3-yl]butan-1-amine Traditional Name: 4-[4-chloro-2-(3-methyl-1H-benzimidazol-2-ylidene)-7-(trifluoromethyl)indol-3-yl]butylamine Formula: C21H20ClF3N4 MolecularWeight: 420.85851

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2NC1=C3C(=C4C(=CC=C(C4=N3)C(F)(F)F)Cl)CCCCN

Isomeric SMILES

CN1C2=CC=CC=C2NC1=C3C(=C4C(=CC=C(C4=N3)C(F)(F)F)Cl)CCCCN

InChI

InChI=1S/C21H20ClF3N4/c1-29-16-8-3-2-7-15(16)27-20(29)18-12(6-4-5-11-26)17-14(22)10-9-13(19(17)28-18)21(23,24)25/h2-3,7-10,27H,4-6,11,26H2,1H3