7-chloranyl-5-phenyl-1-(pyridin-2-ylmethyl)-3H-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-5-phenyl-1-(pyridin-2-ylmethyl)-3H-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-5-phenyl-1-(2-pyridylmethyl)-3H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-5-phenyl-1-(2-pyridinylmethyl)-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-5-phenyl-1-(pyridin-2-ylmethyl)-3H-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-5-phenyl-1-(2-pyridylmethyl)-3H-1,4-benzodiazepin-2-one Formula: C21H16ClN3O MolecularWeight: 361.82424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CC4=CC=CC=N4

Isomeric SMILES

C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CC4=CC=CC=N4

InChI

InChI=1S/C21H16ClN3O/c22-16-9-10-19-18(12-16)21(15-6-2-1-3-7-15)24-13-20(26)25(19)14-17-8-4-5-11-23-17/h1-12H,13-14H2