(3R)-3-azanyl-5-cycloheptyl-1-(2-morpholin-4-ylethyl)-3H-1,4-benzodiazepin-2-one

Systemtic Name: (3R)-3-azanyl-5-cycloheptyl-1-(2-morpholin-4-ylethyl)-3H-1,4-benzodiazepin-2-one Openeye Name: (3R)-3-amino-5-cycloheptyl-1-(2-morpholinoethyl)-3H-1,4-benzodiazepin-2-one CAS Name: (3R)-3-amino-5-cycloheptyl-1-[2-(4-morpholinyl)ethyl]-3H-1,4-benzodiazepin-2-one IUPAC Name: (3R)-3-amino-5-cycloheptyl-1-(2-morpholin-4-ylethyl)-3H-1,4-benzodiazepin-2-one Traditional Name: (3R)-3-amino-5-cycloheptyl-1-(2-morpholinoethyl)-3H-1,4-benzodiazepin-2-one Formula: C22H32N4O2 MolecularWeight: 384.51508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)C2=NC(C(=O)N(C3=CC=CC=C32)CCN4CCOCC4)N

Isomeric SMILES

C1CCCC(CC1)C2=N[C@H](C(=O)N(C3=CC=CC=C32)CCN4CCOCC4)N

InChI

InChI=1S/C22H32N4O2/c23-21-22(27)26(12-11-25-13-15-28-16-14-25)19-10-6-5-9-18(19)20(24-21)17-7-3-1-2-4-8-17/h5-6,9-10,17,21H,1-4,7-8,11-16,23H2/t21-/m1/s1