7-chloranyl-3-heptan-3-yl-[1,2,4]triazolo[4,3-c]pyrimidine

Systemtic Name: 7-chloranyl-3-heptan-3-yl-[1,2,4]triazolo[4,3-c]pyrimidine Openeye Name: 7-chloro-3-(1-ethylpentyl)-[1,2,4]triazolo[4,3-c]pyrimidine CAS Name: 7-chloro-3-heptan-3-yl-[1,2,4]triazolo[4,3-c]pyrimidine IUPAC Name: 7-chloro-3-heptan-3-yl-[1,2,4]triazolo[4,3-c]pyrimidine Traditional Name: 7-chloro-3-(1-ethylpentyl)-[1,2,4]triazolo[4,3-c]pyrimidine Formula: C12H17ClN4 MolecularWeight: 252.74318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C1=NN=C2N1C=NC(=C2)Cl

Isomeric SMILES

CCCCC(CC)C1=NN=C2N1C=NC(=C2)Cl

InChI

InChI=1S/C12H17ClN4/c1-3-5-6-9(4-2)12-16-15-11-7-10(13)14-8-17(11)12/h7-9H,3-6H2,1-2H3