7-chloranyl-N2,N3-dimethyl-5-phenyl-N3-(phenylmethyl)-3H-1,4-benzodiazepine-2,3-diamine

Systemtic Name: 7-chloranyl-N2,N3-dimethyl-5-phenyl-N3-(phenylmethyl)-3H-1,4-benzodiazepine-2,3-diamine Openeye Name: N3-benzyl-7-chloro-N2,N3-dimethyl-5-phenyl-3H-1,4-benzodiazepine-2,3-diamine CAS Name: 7-chloro-N2,N3-dimethyl-5-phenyl-N3-(phenylmethyl)-3H-1,4-benzodiazepine-2,3-diamine IUPAC Name: 3-N-benzyl-7-chloro-2-N,3-N-dimethyl-5-phenyl-3H-1,4-benzodiazepine-2,3-diamine Traditional Name: benzyl-[7-chloro-2-(methylamino)-5-phenyl-3H-1,4-benzodiazepin-3-yl]-methyl-amine Formula: C24H23ClN4 MolecularWeight: 402.91922

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC2=C(C=C(C=C2)Cl)C(=NC1N(C)CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CNC1=NC2=C(C=C(C=C2)Cl)C(=NC1N(C)CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H23ClN4/c1-26-23-24(29(2)16-17-9-5-3-6-10-17)28-22(18-11-7-4-8-12-18)20-15-19(25)13-14-21(20)27-23/h3-15,24H,16H2,1-2H3,(H,26,27)