N-(2,3-dihydroindol-1-ylcarbothioyl)-5-(2-phenylethynyl)pyridine-3-carboxamide

Systemtic Name: N-(2,3-dihydroindol-1-ylcarbothioyl)-5-(2-phenylethynyl)pyridine-3-carboxamide Openeye Name: N-(indoline-1-carbothioyl)-5-(2-phenylethynyl)pyridine-3-carboxamide CAS Name: N-[2,3-dihydroindol-1-yl(sulfanylidene)methyl]-5-(2-phenylethynyl)-3-pyridinecarboxamide IUPAC Name: N-(2,3-dihydroindole-1-carbothioyl)-5-(2-phenylethynyl)pyridine-3-carboxamide Traditional Name: N-(indoline-1-carbothioyl)-5-(2-phenylethynyl)nicotinamide Formula: C23H17N3OS MolecularWeight: 383.46558

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)C(=S)NC(=O)C3=CN=CC(=C3)C#CC4=CC=CC=C4

Isomeric SMILES

C1CN(C2=CC=CC=C21)C(=S)NC(=O)C3=CN=CC(=C3)C#CC4=CC=CC=C4

InChI

InChI=1S/C23H17N3OS/c27-22(25-23(28)26-13-12-19-8-4-5-9-21(19)26)20-14-18(15-24-16-20)11-10-17-6-2-1-3-7-17/h1-9,14-16H,12-13H2,(H,25,27,28)