5-(2-piperidin-1-ylethylsulfanyl)-2-pyridin-4-yl-[1,2,4]triazolo[1,5-c]quinazoline

Systemtic Name: 5-(2-piperidin-1-ylethylsulfanyl)-2-pyridin-4-yl-[1,2,4]triazolo[1,5-c]quinazoline Openeye Name: 5-[2-(1-piperidyl)ethylsulfanyl]-2-(4-pyridyl)-[1,2,4]triazolo[1,5-c]quinazoline CAS Name: 5-[2-(1-piperidinyl)ethylthio]-2-pyridin-4-yl-[1,2,4]triazolo[1,5-c]quinazoline IUPAC Name: 5-(2-piperidin-1-ylethylsulfanyl)-2-pyridin-4-yl-[1,2,4]triazolo[1,5-c]quinazoline Traditional Name: 5-(2-piperidinoethylthio)-2-(4-pyridyl)-[1,2,4]triazolo[1,5-c]quinazoline Formula: C21H22N6S MolecularWeight: 390.50458

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCSC2=NC3=CC=CC=C3C4=NC(=NN42)C5=CC=NC=C5

Isomeric SMILES

C1CCN(CC1)CCSC2=NC3=CC=CC=C3C4=NC(=NN42)C5=CC=NC=C5

InChI

InChI=1S/C21H22N6S/c1-4-12-26(13-5-1)14-15-28-21-23-18-7-3-2-6-17(18)20-24-19(25-27(20)21)16-8-10-22-11-9-16/h2-3,6-11H,1,4-5,12-15H2