5-bromanyl-2-(3,5-dimethoxyphenyl)-1-methyl-3-(2-thiophen-3-ylethynyl)indole

Systemtic Name: 5-bromanyl-2-(3,5-dimethoxyphenyl)-1-methyl-3-(2-thiophen-3-ylethynyl)indole Openeye Name: 5-bromo-2-(3,5-dimethoxyphenyl)-1-methyl-3-[2-(3-thienyl)ethynyl]indole CAS Name: 5-bromo-2-(3,5-dimethoxyphenyl)-1-methyl-3-[2-(3-thiophenyl)ethynyl]indole IUPAC Name: 5-bromo-2-(3,5-dimethoxyphenyl)-1-methyl-3-(2-thiophen-3-ylethynyl)indole Traditional Name: 5-bromo-2-(3,5-dimethoxyphenyl)-1-methyl-3-[2-(3-thienyl)ethynyl]indole Formula: C23H18BrNO2S MolecularWeight: 452.36352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H18BrNO2S/c1-25-22-7-5-17(24)12-21(22)20(6-4-15-8-9-28-14-15)23(25)16-10-18(26-2)13-19(11-16)27-3/h5,7-14H,1-3H3