3-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-(6-piperidin-1-ylpyridin-3-yl)benzamide

Systemtic Name: 3-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-(6-piperidin-1-ylpyridin-3-yl)benzamide Openeye Name: 3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-[6-(1-piperidyl)-3-pyridyl]benzamide CAS Name: 3-[[2-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]-N-[6-(1-piperidinyl)-3-pyridinyl]benzamide IUPAC Name: 3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-(6-piperidin-1-ylpyridin-3-yl)benzamide Traditional Name: 3-[[2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetyl]amino]-N-(6-piperidino-3-pyridyl)benzamide Formula: C22H25N7O2S MolecularWeight: 451.5446

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCC(=O)NC2=CC=CC(=C2)C(=O)NC3=CN=C(C=C3)N4CCCCC4

Isomeric SMILES

CN1C=NN=C1SCC(=O)NC2=CC=CC(=C2)C(=O)NC3=CN=C(C=C3)N4CCCCC4

InChI

InChI=1S/C22H25N7O2S/c1-28-15-24-27-22(28)32-14-20(30)25-17-7-5-6-16(12-17)21(31)26-18-8-9-19(23-13-18)29-10-3-2-4-11-29/h5-9,12-13,15H,2-4,10-11,14H2,1H3,(H,25,30)(H,26,31)