1-[2-(6-chloranylpyridazin-3-yl)-2-sulfanyl-ethanoyl]aziridine-2-carbonitrile

Systemtic Name: 1-[2-(6-chloranylpyridazin-3-yl)-2-sulfanyl-ethanoyl]aziridine-2-carbonitrile Openeye Name: 1-[2-(6-chloropyridazin-3-yl)-2-sulfanyl-acetyl]aziridine-2-carbonitrile CAS Name: 1-[2-(6-chloro-3-pyridazinyl)-2-mercapto-1-oxoethyl]-2-aziridinecarbonitrile IUPAC Name: 1-[2-(6-chloropyridazin-3-yl)-2-sulfanylacetyl]aziridine-2-carbonitrile Traditional Name: 1-[2-(6-chloropyridazin-3-yl)-2-mercapto-acetyl]ethylenimine-2-carbonitrile Formula: C9H7ClN4OS MolecularWeight: 254.69608

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N1C(=O)C(C2=NN=C(C=C2)Cl)S)C#N

Isomeric SMILES

C1C(N1C(=O)C(C2=NN=C(C=C2)Cl)S)C#N

InChI

InChI=1S/C9H7ClN4OS/c10-7-2-1-6(12-13-7)8(16)9(15)14-4-5(14)3-11/h1-2,5,8,16H,4H2