4-(1,2-diazepin-1-yl)-3-phenyl-1-prop-2-ynyl-benzimidazol-2-one

Systemtic Name: 4-(1,2-diazepin-1-yl)-3-phenyl-1-prop-2-ynyl-benzimidazol-2-one Openeye Name: 4-(diazepin-1-yl)-3-phenyl-1-prop-2-ynyl-benzimidazol-2-one CAS Name: 4-(1-diazepinyl)-3-phenyl-1-prop-2-ynyl-2-benzimidazolone IUPAC Name: 4-(diazepin-1-yl)-3-phenyl-1-prop-2-ynylbenzimidazol-2-one Traditional Name: 4-(diazepin-1-yl)-3-phenyl-1-propargyl-benzimidazol-2-one Formula: C21H16N4O MolecularWeight: 340.37794

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C2=C(C(=CC=C2)N3C=CC=CC=N3)N(C1=O)C4=CC=CC=C4

Isomeric SMILES

C#CCN1C2=C(C(=CC=C2)N3C=CC=CC=N3)N(C1=O)C4=CC=CC=C4

InChI

InChI=1S/C21H16N4O/c1-2-15-23-18-12-9-13-19(24-16-8-4-7-14-22-24)20(18)25(21(23)26)17-10-5-3-6-11-17/h1,3-14,16H,15H2