8-cyclopropyl-4-(3-imidazol-1-ylphenyl)-1,3-dihydro-1,5-benzodiazepin-2-one

Systemtic Name: 8-cyclopropyl-4-(3-imidazol-1-ylphenyl)-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 8-cyclopropyl-4-(3-imidazol-1-ylphenyl)-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 8-cyclopropyl-4-[3-(1-imidazolyl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 8-cyclopropyl-4-(3-imidazol-1-ylphenyl)-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 8-cyclopropyl-4-(3-imidazol-1-ylphenyl)-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C21H18N4O MolecularWeight: 342.39382

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC3=C(C=C2)N=C(CC(=O)N3)C4=CC(=CC=C4)N5C=CN=C5

Isomeric SMILES

C1CC1C2=CC3=C(C=C2)N=C(CC(=O)N3)C4=CC(=CC=C4)N5C=CN=C5

InChI

InChI=1S/C21H18N4O/c26-21-12-19(16-2-1-3-17(10-16)25-9-8-22-13-25)23-18-7-6-15(14-4-5-14)11-20(18)24-21/h1-3,6-11,13-14H,4-5,12H2,(H,24,26)