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

Systemtic Name: 6-(3-nitrophenyl)-3-prop-2-ynylsulfanyl-[1,2,4]triazolo[4,3-b]pyridazine Openeye Name: 6-(3-nitrophenyl)-3-prop-2-ynylsulfanyl-[1,2,4]triazolo[4,3-b]pyridazine CAS Name: 6-(3-nitrophenyl)-3-(prop-2-ynylthio)-[1,2,4]triazolo[4,3-b]pyridazine IUPAC Name: 6-(3-nitrophenyl)-3-prop-2-ynylsulfanyl-[1,2,4]triazolo[4,3-b]pyridazine Traditional Name: 6-(3-nitrophenyl)-3-(propargylthio)-[1,2,4]triazolo[4,3-b]pyridazine Formula: C14H9N5O2S MolecularWeight: 311.31856

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Descriptors Computed from Structure

Canonical SMILES:

C#CCSC1=NN=C2N1N=C(C=C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C#CCSC1=NN=C2N1N=C(C=C2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H9N5O2S/c1-2-8-22-14-16-15-13-7-6-12(17-18(13)14)10-4-3-5-11(9-10)19(20)21/h1,3-7,9H,8H2