7-chloranyl-1-(2-morpholin-4-ylethyl)-5-phenyl-3-propyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-1-(2-morpholin-4-ylethyl)-5-phenyl-3-propyl-3H-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-1-(2-morpholinoethyl)-5-phenyl-3-propyl-3H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-1-[2-(4-morpholinyl)ethyl]-5-phenyl-3-propyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-1-(2-morpholin-4-ylethyl)-5-phenyl-3-propyl-3H-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-1-(2-morpholinoethyl)-5-phenyl-3-propyl-3H-1,4-benzodiazepin-2-one Formula: C24H28ClN3O2 MolecularWeight: 425.95102

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CCN4CCOCC4

Isomeric SMILES

CCCC1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CCN4CCOCC4

InChI

InChI=1S/C24H28ClN3O2/c1-2-6-21-24(29)28(12-11-27-13-15-30-16-14-27)22-10-9-19(25)17-20(22)23(26-21)18-7-4-3-5-8-18/h3-5,7-10,17,21H,2,6,11-16H2,1H3