4,6,7-trimethoxy-N-[3-(2-thiophen-2-ylethynyl)phenyl]-1H-indole-2-carboxamide

Systemtic Name: 4,6,7-trimethoxy-N-[3-(2-thiophen-2-ylethynyl)phenyl]-1H-indole-2-carboxamide Openeye Name: 4,6,7-trimethoxy-N-[3-[2-(2-thienyl)ethynyl]phenyl]-1H-indole-2-carboxamide CAS Name: 4,6,7-trimethoxy-N-[3-(2-thiophen-2-ylethynyl)phenyl]-1H-indole-2-carboxamide IUPAC Name: 4,6,7-trimethoxy-N-[3-(2-thiophen-2-ylethynyl)phenyl]-1H-indole-2-carboxamide Traditional Name: 4,6,7-trimethoxy-N-[3-[2-(2-thienyl)ethynyl]phenyl]-1H-indole-2-carboxamide Formula: C24H20N2O4S MolecularWeight: 432.4916

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C2=C1C=C(N2)C(=O)NC3=CC=CC(=C3)C#CC4=CC=CS4)OC)OC

Isomeric SMILES

COC1=CC(=C(C2=C1C=C(N2)C(=O)NC3=CC=CC(=C3)C#CC4=CC=CS4)OC)OC

InChI

InChI=1S/C24H20N2O4S/c1-28-20-14-21(29-2)23(30-3)22-18(20)13-19(26-22)24(27)25-16-7-4-6-15(12-16)9-10-17-8-5-11-31-17/h4-8,11-14,26H,1-3H3,(H,25,27)