7-chloranyl-5-phenyl-N-(phenylmethyl)-4,5-dihydro-1H-1,3-benzodiazepin-2-amine hydrochloride

Systemtic Name: 7-chloranyl-5-phenyl-N-(phenylmethyl)-4,5-dihydro-1H-1,3-benzodiazepin-2-amine hydrochloride Openeye Name: N-benzyl-7-chloro-5-phenyl-4,5-dihydro-1H-1,3-benzodiazepin-2-amine hydrochloride CAS Name: 7-chloro-5-phenyl-N-(phenylmethyl)-4,5-dihydro-1H-1,3-benzodiazepin-2-amine hydrochloride IUPAC Name: N-benzyl-7-chloro-5-phenyl-4,5-dihydro-1H-1,3-benzodiazepin-2-amine hydrochloride Traditional Name: benzyl-(7-chloro-5-phenyl-4,5-dihydro-1H-1,3-benzodiazepin-2-yl)amine hydrochloride Formula: C22H21Cl2N3 MolecularWeight: 398.32824

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(C=CC(=C2)Cl)NC(=N1)NCC3=CC=CC=C3)C4=CC=CC=C4.Cl

Isomeric SMILES

C1C(C2=C(C=CC(=C2)Cl)NC(=N1)NCC3=CC=CC=C3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C22H20ClN3.ClH/c23-18-11-12-21-19(13-18)20(17-9-5-2-6-10-17)15-25-22(26-21)24-14-16-7-3-1-4-8-16;/h1-13,20H,14-15H2,(H2,24,25,26);1H