3-cyclopentylsulfanyl-6-(3-nitrophenyl)-[1,2,4]triazolo[4,3-b]pyridazine

Systemtic Name: 3-cyclopentylsulfanyl-6-(3-nitrophenyl)-[1,2,4]triazolo[4,3-b]pyridazine Openeye Name: 3-cyclopentylsulfanyl-6-(3-nitrophenyl)-[1,2,4]triazolo[4,3-b]pyridazine CAS Name: 3-(cyclopentylthio)-6-(3-nitrophenyl)-[1,2,4]triazolo[4,3-b]pyridazine IUPAC Name: 3-cyclopentylsulfanyl-6-(3-nitrophenyl)-[1,2,4]triazolo[4,3-b]pyridazine Traditional Name: 3-(cyclopentylthio)-6-(3-nitrophenyl)-[1,2,4]triazolo[4,3-b]pyridazine Formula: C16H15N5O2S MolecularWeight: 341.3876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SC2=NN=C3N2N=C(C=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)SC2=NN=C3N2N=C(C=C3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H15N5O2S/c22-21(23)12-5-3-4-11(10-12)14-8-9-15-17-18-16(20(15)19-14)24-13-6-1-2-7-13/h3-5,8-10,13H,1-2,6-7H2