(2-chloranylpyridin-3-yl)-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]methanone

Systemtic Name: (2-chloranylpyridin-3-yl)-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]methanone Openeye Name: (2-chloro-3-pyridyl)-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]methanone CAS Name: (2-chloro-3-pyridinyl)-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]methanone IUPAC Name: (2-chloropyridin-3-yl)-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]methanone Traditional Name: (2-chloro-3-pyridyl)-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]methanone Formula: C25H22ClN5O MolecularWeight: 443.92808

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C(CN1C(=O)C3=C(N=CC=C3)Cl)C=C(C=C2)C4=CC=CC=C4)CC5=CN=CN5

Isomeric SMILES

C1CN(C2=C(CN1C(=O)C3=C(N=CC=C3)Cl)C=C(C=C2)C4=CC=CC=C4)CC5=CN=CN5

InChI

InChI=1S/C25H22ClN5O/c26-24-22(7-4-10-28-24)25(32)31-12-11-30(16-21-14-27-17-29-21)23-9-8-19(13-20(23)15-31)18-5-2-1-3-6-18/h1-10,13-14,17H,11-12,15-16H2,(H,27,29)