3-azanyl-5-cyclohexyl-1-(pyridin-2-ylmethyl)-3H-1,4-benzodiazepin-2-one

Systemtic Name: 3-azanyl-5-cyclohexyl-1-(pyridin-2-ylmethyl)-3H-1,4-benzodiazepin-2-one Openeye Name: 3-amino-5-cyclohexyl-1-(2-pyridylmethyl)-3H-1,4-benzodiazepin-2-one CAS Name: 3-amino-5-cyclohexyl-1-(2-pyridinylmethyl)-3H-1,4-benzodiazepin-2-one IUPAC Name: 3-amino-5-cyclohexyl-1-(pyridin-2-ylmethyl)-3H-1,4-benzodiazepin-2-one Traditional Name: 3-amino-5-cyclohexyl-1-(2-pyridylmethyl)-3H-1,4-benzodiazepin-2-one Formula: C21H24N4O MolecularWeight: 348.44146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NC(C(=O)N(C3=CC=CC=C32)CC4=CC=CC=N4)N

Isomeric SMILES

C1CCC(CC1)C2=NC(C(=O)N(C3=CC=CC=C32)CC4=CC=CC=N4)N

InChI

InChI=1S/C21H24N4O/c22-20-21(26)25(14-16-10-6-7-13-23-16)18-12-5-4-11-17(18)19(24-20)15-8-2-1-3-9-15/h4-7,10-13,15,20H,1-3,8-9,14,22H2