2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(6-pyrrolidin-1-ylpyridin-3-yl)ethanamide

Systemtic Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(6-pyrrolidin-1-ylpyridin-3-yl)ethanamide Openeye Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(6-pyrrolidin-1-yl-3-pyridyl)acetamide CAS Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-N-[6-(1-pyrrolidinyl)-3-pyridinyl]acetamide IUPAC Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(6-pyrrolidin-1-ylpyridin-3-yl)acetamide Traditional Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-N-(6-pyrrolidino-3-pyridyl)acetamide Formula: C25H24N6OS MolecularWeight: 456.56266

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC=C(C=C2)NC(=O)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C2=NC=C(C=C2)NC(=O)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H24N6OS/c32-23(27-20-13-14-22(26-17-20)30-15-7-8-16-30)18-33-25-29-28-24(19-9-3-1-4-10-19)31(25)21-11-5-2-6-12-21/h1-6,9-14,17H,7-8,15-16,18H2,(H,27,32)