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

Systemtic Name: 7-chloranyl-N2-ethyl-N3,N3-dimethyl-5-phenyl-3H-1,4-benzodiazepine-2,3-diamine Openeye Name: 7-chloro-N2-ethyl-N3,N3-dimethyl-5-phenyl-3H-1,4-benzodiazepine-2,3-diamine CAS Name: 7-chloro-N2-ethyl-N3,N3-dimethyl-5-phenyl-3H-1,4-benzodiazepine-2,3-diamine IUPAC Name: 7-chloro-2-N-ethyl-3-N,3-N-dimethyl-5-phenyl-3H-1,4-benzodiazepine-2,3-diamine Traditional Name: [7-chloro-2-(ethylamino)-5-phenyl-3H-1,4-benzodiazepin-3-yl]-dimethyl-amine Formula: C19H21ClN4 MolecularWeight: 340.84984

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC2=C(C=C(C=C2)Cl)C(=NC1N(C)C)C3=CC=CC=C3

Isomeric SMILES

CCNC1=NC2=C(C=C(C=C2)Cl)C(=NC1N(C)C)C3=CC=CC=C3

InChI

InChI=1S/C19H21ClN4/c1-4-21-18-19(24(2)3)23-17(13-8-6-5-7-9-13)15-12-14(20)10-11-16(15)22-18/h5-12,19H,4H2,1-3H3,(H,21,22)