3-(1H-imidazol-5-ylmethyl)-7,8-dimethoxy-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 3-(1H-imidazol-5-ylmethyl)-7,8-dimethoxy-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one Openeye Name: 3-(1H-imidazol-5-ylmethyl)-7,8-dimethoxy-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one CAS Name: 3-(1H-imidazol-5-ylmethyl)-7,8-dimethoxy-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 3-(1H-imidazol-5-ylmethyl)-7,8-dimethoxy-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one Traditional Name: 3-(1H-imidazol-5-ylmethyl)-7,8-dimethoxy-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one Formula: C21H20N4O3 MolecularWeight: 376.4085

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(C(=O)N2)CC3=CN=CN3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(C(=O)N2)CC3=CN=CN3)C4=CC=CC=C4)OC

InChI

InChI=1S/C21H20N4O3/c1-27-18-9-15-16(10-19(18)28-2)25-21(26)17(8-14-11-22-12-23-14)24-20(15)13-6-4-3-5-7-13/h3-7,9-12,17H,8H2,1-2H3,(H,22,23)(H,25,26)