4-[2-(5-bromanylthiophen-2-yl)-5-phenoxy-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[2-(5-bromanylthiophen-2-yl)-5-phenoxy-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(5-bromo-2-thienyl)-5-phenoxy-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(5-bromo-2-thiophenyl)-5-phenoxy-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(5-bromothiophen-2-yl)-5-phenoxy-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-(5-bromo-2-thienyl)-5-phenoxy-1H-indol-3-yl]butylamine Formula: C22H21BrN2OS MolecularWeight: 441.38394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC3=C(C=C2)NC(=C3CCCCN)C4=CC=C(S4)Br

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC3=C(C=C2)NC(=C3CCCCN)C4=CC=C(S4)Br

InChI

InChI=1S/C22H21BrN2OS/c23-21-12-11-20(27-21)22-17(8-4-5-13-24)18-14-16(9-10-19(18)25-22)26-15-6-2-1-3-7-15/h1-3,6-7,9-12,14,25H,4-5,8,13,24H2