4-chloranyl-2-[(4-chloranyl-2-sulfanyl-butan-2-yl)-phenyl-amino]butane-2-thiol hydrochloride

Systemtic Name: 4-chloranyl-2-[(4-chloranyl-2-sulfanyl-butan-2-yl)-phenyl-amino]butane-2-thiol hydrochloride Openeye Name: 4-chloro-2-(N-(3-chloro-1-methyl-1-sulfanyl-propyl)anilino)butane-2-thiol hydrochloride CAS Name: 4-chloro-2-(N-(4-chloro-2-mercaptobutan-2-yl)anilino)-2-butanethiol hydrochloride IUPAC Name: 4-chloro-2-(N-(4-chloro-2-sulfanylbutan-2-yl)anilino)butane-2-thiol hydrochloride Traditional Name: 4-chloro-2-(N-(3-chloro-1-mercapto-1-methyl-propyl)anilino)butane-2-thiol hydrochloride Formula: C14H22Cl3NS2 MolecularWeight: 374.82018

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCl)(N(C1=CC=CC=C1)C(C)(CCCl)S)S.Cl

Isomeric SMILES

CC(CCCl)(N(C1=CC=CC=C1)C(C)(CCCl)S)S.Cl

InChI

InChI=1S/C14H21Cl2NS2.ClH/c1-13(18,8-10-15)17(14(2,19)9-11-16)12-6-4-3-5-7-12;/h3-7,18-19H,8-11H2,1-2H3;1H