7-chloranyl-N-ethyl-3-morpholin-4-yl-5-phenyl-3H-1,4-benzodiazepin-2-amine

Systemtic Name: 7-chloranyl-N-ethyl-3-morpholin-4-yl-5-phenyl-3H-1,4-benzodiazepin-2-amine Openeye Name: 7-chloro-N-ethyl-3-morpholino-5-phenyl-3H-1,4-benzodiazepin-2-amine CAS Name: 7-chloro-N-ethyl-3-(4-morpholinyl)-5-phenyl-3H-1,4-benzodiazepin-2-amine IUPAC Name: 7-chloro-N-ethyl-3-morpholin-4-yl-5-phenyl-3H-1,4-benzodiazepin-2-amine Traditional Name: (7-chloro-3-morpholino-5-phenyl-3H-1,4-benzodiazepin-2-yl)-ethyl-amine Formula: C21H23ClN4O MolecularWeight: 382.88652

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC2=C(C=C(C=C2)Cl)C(=NC1N3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

CCNC1=NC2=C(C=C(C=C2)Cl)C(=NC1N3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C21H23ClN4O/c1-2-23-20-21(26-10-12-27-13-11-26)25-19(15-6-4-3-5-7-15)17-14-16(22)8-9-18(17)24-20/h3-9,14,21H,2,10-13H2,1H3,(H,23,24)