5-methyl-2-propylsulfanyl-N-pyridin-3-yl-7-pyridin-4-yl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide

Systemtic Name: 5-methyl-2-propylsulfanyl-N-pyridin-3-yl-7-pyridin-4-yl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide Openeye Name: 5-methyl-2-propylsulfanyl-N-(3-pyridyl)-7-(4-pyridyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide CAS Name: 5-methyl-2-(propylthio)-N-(3-pyridinyl)-7-pyridin-4-yl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide IUPAC Name: 5-methyl-2-propylsulfanyl-N-pyridin-3-yl-7-pyridin-4-yl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide Traditional Name: 5-methyl-2-(propylthio)-N-(3-pyridyl)-7-(4-pyridyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide Formula: C20H21N7OS MolecularWeight: 407.49204

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC2=NC(=C(C(N2N1)C3=CC=NC=C3)C(=O)NC4=CN=CC=C4)C

Isomeric SMILES

CCCSC1=NC2=NC(=C(C(N2N1)C3=CC=NC=C3)C(=O)NC4=CN=CC=C4)C

InChI

InChI=1S/C20H21N7OS/c1-3-11-29-20-25-19-23-13(2)16(18(28)24-15-5-4-8-22-12-15)17(27(19)26-20)14-6-9-21-10-7-14/h4-10,12,17H,3,11H2,1-2H3,(H,24,28)(H,23,25,26)