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

Systemtic Name: 4-[2-(1-benzothiophen-2-yl)-4-chloranyl-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(benzothiophen-2-yl)-4-chloro-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(1-benzothiophen-2-yl)-4-chloro-7-(trifluoromethyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(1-benzothiophen-2-yl)-4-chloro-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-(benzothiophen-2-yl)-4-chloro-7-(trifluoromethyl)-1H-indol-3-yl]butylamine Formula: C21H18ClF3N2S MolecularWeight: 422.89423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(S2)C3=C(C4=C(C=CC(=C4N3)C(F)(F)F)Cl)CCCCN

Isomeric SMILES

C1=CC=C2C(=C1)C=C(S2)C3=C(C4=C(C=CC(=C4N3)C(F)(F)F)Cl)CCCCN

InChI

InChI=1S/C21H18ClF3N2S/c22-15-9-8-14(21(23,24)25)20-18(15)13(6-3-4-10-26)19(27-20)17-11-12-5-1-2-7-16(12)28-17/h1-2,5,7-9,11,27H,3-4,6,10,26H2