methyl 7-chloranyl-5-(2-chlorophenyl)-2,3-dihydro-1,4-benzodiazepine-1-carboximidothioate hydroiodide

Systemtic Name: methyl 7-chloranyl-5-(2-chlorophenyl)-2,3-dihydro-1,4-benzodiazepine-1-carboximidothioate hydroiodide Openeye Name: methyl 7-chloro-5-(2-chlorophenyl)-2,3-dihydro-1,4-benzodiazepine-1-carboximidothioate hydroiodide CAS Name: 7-chloro-5-(2-chlorophenyl)-2,3-dihydro-1,4-benzodiazepine-1-carboximidothioic acid methyl ester hydroiodide IUPAC Name: methyl 7-chloro-5-(2-chlorophenyl)-2,3-dihydro-1,4-benzodiazepine-1-carboximidothioate hydroiodide Traditional Name: 7-chloro-5-(2-chlorophenyl)-2,3-dihydro-1,4-benzodiazepine-1-carboximidothioic acid methyl ester hydroiodide Formula: C17H16Cl2IN3S MolecularWeight: 492.20451

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=N)N1CCN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3Cl.I

Isomeric SMILES

CSC(=N)N1CCN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3Cl.I

InChI

InChI=1S/C17H15Cl2N3S.HI/c1-23-17(20)22-9-8-21-16(12-4-2-3-5-14(12)19)13-10-11(18)6-7-15(13)22;/h2-7,10,20H,8-9H2,1H3;1H