7-chloranyl-2-(2-diethylaminoethylamino)-4-methyl-3H-1,4-benzodiazepin-5-one dihydrochloride

Systemtic Name: 7-chloranyl-2-(2-diethylaminoethylamino)-4-methyl-3H-1,4-benzodiazepin-5-one dihydrochloride Openeye Name: 7-chloro-2-(2-diethylaminoethylamino)-4-methyl-3H-1,4-benzodiazepin-5-one dihydrochloride CAS Name: 7-chloro-2-(2-diethylaminoethylamino)-4-methyl-3H-1,4-benzodiazepin-5-one dihydrochloride IUPAC Name: 7-chloro-2-(2-diethylaminoethylamino)-4-methyl-3H-1,4-benzodiazepin-5-one dihydrochloride Traditional Name: 7-chloro-2-(2-diethylaminoethylamino)-4-methyl-3H-1,4-benzodiazepin-5-one dihydrochloride Formula: C16H25Cl3N4O MolecularWeight: 395.7549

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=NC2=C(C=C(C=C2)Cl)C(=O)N(C1)C.Cl.Cl

Isomeric SMILES

CCN(CC)CCNC1=NC2=C(C=C(C=C2)Cl)C(=O)N(C1)C.Cl.Cl

InChI

InChI=1S/C16H23ClN4O.2ClH/c1-4-21(5-2)9-8-18-15-11-20(3)16(22)13-10-12(17)6-7-14(13)19-15;;/h6-7,10H,4-5,8-9,11H2,1-3H3,(H,18,19);2*1H