7-chloranyl-4-[[4-(3-ethoxypropyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]quinazoline

Systemtic Name: 7-chloranyl-4-[[4-(3-ethoxypropyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]quinazoline Openeye Name: 7-chloro-4-[[4-(3-ethoxypropyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]quinazoline CAS Name: 7-chloro-4-[[4-(3-ethoxypropyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]quinazoline IUPAC Name: 7-chloro-4-[[4-(3-ethoxypropyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]quinazoline Traditional Name: 7-chloro-4-[[4-(3-ethoxypropyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]quinazoline Formula: C20H19ClN6OS MolecularWeight: 426.92246

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=NN=C1SC2=NC=NC3=C2C=CC(=C3)Cl)C4=CC=NC=C4

Isomeric SMILES

CCOCCCN1C(=NN=C1SC2=NC=NC3=C2C=CC(=C3)Cl)C4=CC=NC=C4

InChI

InChI=1S/C20H19ClN6OS/c1-2-28-11-3-10-27-18(14-6-8-22-9-7-14)25-26-20(27)29-19-16-5-4-15(21)12-17(16)23-13-24-19/h4-9,12-13H,2-3,10-11H2,1H3