[1-(1H-imidazol-5-ylmethyl)-7-methoxy-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-naphthalen-1-yl-methanone dihydrochloride

Systemtic Name: [1-(1H-imidazol-5-ylmethyl)-7-methoxy-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-naphthalen-1-yl-methanone dihydrochloride Openeye Name: [1-(1H-imidazol-5-ylmethyl)-7-methoxy-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-(1-naphthyl)methanone dihydrochloride CAS Name: [1-(1H-imidazol-5-ylmethyl)-7-methoxy-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-(1-naphthalenyl)methanone dihydrochloride IUPAC Name: [1-(1H-imidazol-5-ylmethyl)-7-methoxy-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-naphthalen-1-ylmethanone dihydrochloride Traditional Name: [1-(1H-imidazol-5-ylmethyl)-7-methoxy-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-(1-naphthyl)methanone dihydrochloride Formula: C25H26Cl2N4O2 MolecularWeight: 485.40554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(CCN(C2)C(=O)C3=CC=CC4=CC=CC=C43)CC5=CN=CN5.Cl.Cl

Isomeric SMILES

COC1=CC2=C(C=C1)N(CCN(C2)C(=O)C3=CC=CC4=CC=CC=C43)CC5=CN=CN5.Cl.Cl

InChI

InChI=1S/C25H24N4O2.2ClH/c1-31-21-9-10-24-19(13-21)15-29(12-11-28(24)16-20-14-26-17-27-20)25(30)23-8-4-6-18-5-2-3-7-22(18)23;;/h2-10,13-14,17H,11-12,15-16H2,1H3,(H,26,27);2*1H