5-bromanyl-2-(4-methoxyphenyl)-1-methyl-3-(2-thiophen-3-ylethynyl)indole

Systemtic Name: 5-bromanyl-2-(4-methoxyphenyl)-1-methyl-3-(2-thiophen-3-ylethynyl)indole Openeye Name: 5-bromo-2-(4-methoxyphenyl)-1-methyl-3-[2-(3-thienyl)ethynyl]indole CAS Name: 5-bromo-2-(4-methoxyphenyl)-1-methyl-3-[2-(3-thiophenyl)ethynyl]indole IUPAC Name: 5-bromo-2-(4-methoxyphenyl)-1-methyl-3-(2-thiophen-3-ylethynyl)indole Traditional Name: 5-bromo-2-(4-methoxyphenyl)-1-methyl-3-[2-(3-thienyl)ethynyl]indole Formula: C22H16BrNOS MolecularWeight: 422.33754

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)Br)C(=C1C3=CC=C(C=C3)OC)C#CC4=CSC=C4

Isomeric SMILES

CN1C2=C(C=C(C=C2)Br)C(=C1C3=CC=C(C=C3)OC)C#CC4=CSC=C4

InChI

InChI=1S/C22H16BrNOS/c1-24-21-10-6-17(23)13-20(21)19(9-3-15-11-12-26-14-15)22(24)16-4-7-18(25-2)8-5-16/h4-8,10-14H,1-2H3