N-(6-morpholin-4-ylpyridin-3-yl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide

Systemtic Name: N-(6-morpholin-4-ylpyridin-3-yl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Openeye Name: N-(6-morpholino-3-pyridyl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide CAS Name: N-[6-(4-morpholinyl)-3-pyridinyl]-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide IUPAC Name: N-(6-morpholin-4-ylpyridin-3-yl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Traditional Name: N-(6-morpholino-3-pyridyl)-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide Formula: C19H20N6O2S MolecularWeight: 396.4661

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC=C(C=C2)NC(=O)C3=CC=C(C=C3)CSC4=NC=NN4

Isomeric SMILES

C1COCCN1C2=NC=C(C=C2)NC(=O)C3=CC=C(C=C3)CSC4=NC=NN4

InChI

InChI=1S/C19H20N6O2S/c26-18(15-3-1-14(2-4-15)12-28-19-21-13-22-24-19)23-16-5-6-17(20-11-16)25-7-9-27-10-8-25/h1-6,11,13H,7-10,12H2,(H,23,26)(H,21,22,24)