3-[6-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-5-yl]-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)propanamide

Systemtic Name: 3-[6-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-5-yl]-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)propanamide Openeye Name: 3-(2-benzylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)propanamide CAS Name: 3-[6-methyl-4-oxo-2-(phenylmethylthio)-1H-pyrimidin-5-yl]-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)propanamide IUPAC Name: 3-(2-benzylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)propanamide Traditional Name: 3-[2-(benzylthio)-4-keto-6-methyl-1H-pyrimidin-5-yl]-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)propionamide Formula: C22H22N6O2S MolecularWeight: 434.51408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)CCC(=O)NCC3=NN=C4N3C=CC=C4

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)CCC(=O)NCC3=NN=C4N3C=CC=C4

InChI

InChI=1S/C22H22N6O2S/c1-15-17(21(30)25-22(24-15)31-14-16-7-3-2-4-8-16)10-11-20(29)23-13-19-27-26-18-9-5-6-12-28(18)19/h2-9,12H,10-11,13-14H2,1H3,(H,23,29)(H,24,25,30)