4-(7-pyridin-4-yl-2,3-dihydro-1H-1,4-benzodiazepin-5-yl)benzenecarbonitrile

Systemtic Name: 4-(7-pyridin-4-yl-2,3-dihydro-1H-1,4-benzodiazepin-5-yl)benzenecarbonitrile Openeye Name: 4-[7-(4-pyridyl)-2,3-dihydro-1H-1,4-benzodiazepin-5-yl]benzonitrile CAS Name: 4-(7-pyridin-4-yl-2,3-dihydro-1H-1,4-benzodiazepin-5-yl)benzonitrile IUPAC Name: 4-(7-pyridin-4-yl-2,3-dihydro-1H-1,4-benzodiazepin-5-yl)benzonitrile Traditional Name: 4-[7-(4-pyridyl)-2,3-dihydro-1H-1,4-benzodiazepin-5-yl]benzonitrile Formula: C21H16N4 MolecularWeight: 324.37854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(C2=C(N1)C=CC(=C2)C3=CC=NC=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN=C(C2=C(N1)C=CC(=C2)C3=CC=NC=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C21H16N4/c22-14-15-1-3-17(4-2-15)21-19-13-18(16-7-9-23-10-8-16)5-6-20(19)24-11-12-25-21/h1-10,13,24H,11-12H2