1-methyl-3-[3-oxidanylidene-3-[4-(phenylmethyl)-1,4-diazepan-1-yl]propyl]benzimidazol-2-one

Systemtic Name: 1-methyl-3-[3-oxidanylidene-3-[4-(phenylmethyl)-1,4-diazepan-1-yl]propyl]benzimidazol-2-one Openeye Name: 1-[3-(4-benzyl-1,4-diazepan-1-yl)-3-oxo-propyl]-3-methyl-benzimidazol-2-one CAS Name: 1-methyl-3-[3-oxo-3-[4-(phenylmethyl)-1,4-diazepan-1-yl]propyl]-2-benzimidazolone IUPAC Name: 1-[3-(4-benzyl-1,4-diazepan-1-yl)-3-oxopropyl]-3-methylbenzimidazol-2-one Traditional Name: 1-[3-(4-benzyl-1,4-diazepan-1-yl)-3-keto-propyl]-3-methyl-benzimidazol-2-one Formula: C23H28N4O2 MolecularWeight: 392.49402

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=O)CCC(=O)N3CCCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=O)CCC(=O)N3CCCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H28N4O2/c1-24-20-10-5-6-11-21(20)27(23(24)29)15-12-22(28)26-14-7-13-25(16-17-26)18-19-8-3-2-4-9-19/h2-6,8-11H,7,12-18H2,1H3