2-(2-dimethylaminoethylamino)-4-methyl-3-phenyl-3H-1,4-benzodiazepin-5-one dihydrochloride

Systemtic Name: 2-(2-dimethylaminoethylamino)-4-methyl-3-phenyl-3H-1,4-benzodiazepin-5-one dihydrochloride Openeye Name: 2-(2-dimethylaminoethylamino)-4-methyl-3-phenyl-3H-1,4-benzodiazepin-5-one dihydrochloride CAS Name: 2-(2-dimethylaminoethylamino)-4-methyl-3-phenyl-3H-1,4-benzodiazepin-5-one dihydrochloride IUPAC Name: 2-(2-dimethylaminoethylamino)-4-methyl-3-phenyl-3H-1,4-benzodiazepin-5-one dihydrochloride Traditional Name: 2-(2-dimethylaminoethylamino)-4-methyl-3-phenyl-3H-1,4-benzodiazepin-5-one dihydrochloride Formula: C20H26Cl2N4O MolecularWeight: 409.35264

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(=NC2=CC=CC=C2C1=O)NCCN(C)C)C3=CC=CC=C3.Cl.Cl

Isomeric SMILES

CN1C(C(=NC2=CC=CC=C2C1=O)NCCN(C)C)C3=CC=CC=C3.Cl.Cl

InChI

InChI=1S/C20H24N4O.2ClH/c1-23(2)14-13-21-19-18(15-9-5-4-6-10-15)24(3)20(25)16-11-7-8-12-17(16)22-19;;/h4-12,18H,13-14H2,1-3H3,(H,21,22);2*1H