4-[5-chloranyl-2-(3-methyl-1H-benzimidazol-2-ylidene)-7-(trifluoromethyl)indol-3-yl]butan-1-amine

Systemtic Name: 4-[5-chloranyl-2-(3-methyl-1H-benzimidazol-2-ylidene)-7-(trifluoromethyl)indol-3-yl]butan-1-amine Openeye Name: 4-[5-chloro-2-(3-methyl-1H-benzimidazol-2-ylidene)-7-(trifluoromethyl)indol-3-yl]butan-1-amine CAS Name: 4-[5-chloro-2-(3-methyl-1H-benzimidazol-2-ylidene)-7-(trifluoromethyl)-3-indolyl]-1-butanamine IUPAC Name: 4-[5-chloro-2-(3-methyl-1H-benzimidazol-2-ylidene)-7-(trifluoromethyl)indol-3-yl]butan-1-amine Traditional Name: 4-[5-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=C(C=C(C4=N3)C(F)(F)F)Cl)CCCCN

Isomeric SMILES

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

InChI

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