[3-methyl-4-[3-(3-nitroimidazo[1,2-b]pyridazin-6-yl)sulfanylpropylsulfanyl]pyridin-2-yl]-pyridin-4-yl-methanethiol

Systemtic Name: [3-methyl-4-[3-(3-nitroimidazo[1,2-b]pyridazin-6-yl)sulfanylpropylsulfanyl]pyridin-2-yl]-pyridin-4-yl-methanethiol Openeye Name: [3-methyl-4-[3-(3-nitroimidazo[1,2-b]pyridazin-6-yl)sulfanylpropylsulfanyl]-2-pyridyl]-(4-pyridyl)methanethiol CAS Name: [3-methyl-4-[3-[(3-nitro-6-imidazo[1,2-b]pyridazinyl)thio]propylthio]-2-pyridinyl]-pyridin-4-ylmethanethiol IUPAC Name: [3-methyl-4-[3-(3-nitroimidazo[1,2-b]pyridazin-6-yl)sulfanylpropylsulfanyl]pyridin-2-yl]-pyridin-4-ylmethanethiol Traditional Name: [3-methyl-4-[3-[(3-nitroimidazo[1,2-b]pyridazin-6-yl)thio]propylthio]-2-pyridyl]-(4-pyridyl)methanethiol Formula: C21H20N6O2S3 MolecularWeight: 484.6175

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1C(C2=CC=NC=C2)S)SCCCSC3=NN4C(=NC=C4[N+](=O)[O-])C=C3

Isomeric SMILES

CC1=C(C=CN=C1C(C2=CC=NC=C2)S)SCCCSC3=NN4C(=NC=C4[N+](=O)[O-])C=C3

InChI

InChI=1S/C21H20N6O2S3/c1-14-16(7-10-23-20(14)21(30)15-5-8-22-9-6-15)31-11-2-12-32-18-4-3-17-24-13-19(27(28)29)26(17)25-18/h3-10,13,21,30H,2,11-12H2,1H3