4-[2-(4-methoxyphenyl)-1-methyl-3-(2-thiophen-3-ylethynyl)indol-5-yl]benzamide

Systemtic Name: 4-[2-(4-methoxyphenyl)-1-methyl-3-(2-thiophen-3-ylethynyl)indol-5-yl]benzamide Openeye Name: 4-[2-(4-methoxyphenyl)-1-methyl-3-[2-(3-thienyl)ethynyl]indol-5-yl]benzamide CAS Name: 4-[2-(4-methoxyphenyl)-1-methyl-3-[2-(3-thiophenyl)ethynyl]-5-indolyl]benzamide IUPAC Name: 4-[2-(4-methoxyphenyl)-1-methyl-3-(2-thiophen-3-ylethynyl)indol-5-yl]benzamide Traditional Name: 4-[2-(4-methoxyphenyl)-1-methyl-3-[2-(3-thienyl)ethynyl]indol-5-yl]benzamide Formula: C29H22N2O2S MolecularWeight: 462.56218

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C3=CC=C(C=C3)C(=O)N)C(=C1C4=CC=C(C=C4)OC)C#CC5=CSC=C5

Isomeric SMILES

CN1C2=C(C=C(C=C2)C3=CC=C(C=C3)C(=O)N)C(=C1C4=CC=C(C=C4)OC)C#CC5=CSC=C5

InChI

InChI=1S/C29H22N2O2S/c1-31-27-14-10-23(20-4-6-22(7-5-20)29(30)32)17-26(27)25(13-3-19-15-16-34-18-19)28(31)21-8-11-24(33-2)12-9-21/h4-12,14-18H,1-2H3,(H2,30,32)