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

Systemtic Name: 4-(1,2-diazepin-1-yl)-3-methyl-1-prop-2-ynyl-benzimidazol-2-one Openeye Name: 4-(diazepin-1-yl)-3-methyl-1-prop-2-ynyl-benzimidazol-2-one CAS Name: 4-(1-diazepinyl)-3-methyl-1-prop-2-ynyl-2-benzimidazolone IUPAC Name: 4-(diazepin-1-yl)-3-methyl-1-prop-2-ynylbenzimidazol-2-one Traditional Name: 4-(diazepin-1-yl)-3-methyl-1-propargyl-benzimidazol-2-one Formula: C16H14N4O MolecularWeight: 278.30856

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC=C2N3C=CC=CC=N3)N(C1=O)CC#C

Isomeric SMILES

CN1C2=C(C=CC=C2N3C=CC=CC=N3)N(C1=O)CC#C

InChI

InChI=1S/C16H14N4O/c1-3-11-19-13-8-7-9-14(15(13)18(2)16(19)21)20-12-6-4-5-10-17-20/h1,4-10,12H,11H2,2H3