4,5-bis(chloranyl)-1-(1-sulfanylbutoxymethyl)imidazole-2-carbonitrile

Systemtic Name: 4,5-bis(chloranyl)-1-(1-sulfanylbutoxymethyl)imidazole-2-carbonitrile Openeye Name: 4,5-dichloro-1-(1-sulfanylbutoxymethyl)imidazole-2-carbonitrile CAS Name: 4,5-dichloro-1-(1-mercaptobutoxymethyl)-2-imidazolecarbonitrile IUPAC Name: 4,5-dichloro-1-(1-sulfanylbutoxymethyl)imidazole-2-carbonitrile Traditional Name: 4,5-dichloro-1-(1-mercaptobutoxymethyl)imidazole-2-carbonitrile Formula: C9H11Cl2N3OS MolecularWeight: 280.17414

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(OCN1C(=NC(=C1Cl)Cl)C#N)S

Isomeric SMILES

CCCC(OCN1C(=NC(=C1Cl)Cl)C#N)S

InChI

InChI=1S/C9H11Cl2N3OS/c1-2-3-7(16)15-5-14-6(4-12)13-8(10)9(14)11/h7,16H,2-3,5H2,1H3