4-(1H-indazol-3-ylcarbonyl)-1-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-6-phenylmethoxy-1,4-diazepan-2-one

Systemtic Name: 4-(1H-indazol-3-ylcarbonyl)-1-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-6-phenylmethoxy-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-4-(1H-indazole-3-carbonyl)-1-[3-(2-oxopyrrolidin-1-yl)propyl]-1,4-diazepan-2-one CAS Name: 4-[1H-indazol-3-yl(oxo)methyl]-1-[3-(2-oxo-1-pyrrolidinyl)propyl]-6-phenylmethoxy-1,4-diazepan-2-one IUPAC Name: 4-(1H-indazole-3-carbonyl)-1-[3-(2-oxopyrrolidin-1-yl)propyl]-6-phenylmethoxy-1,4-diazepan-2-one Traditional Name: 6-benzoxy-4-(1H-indazole-3-carbonyl)-1-[3-(2-ketopyrrolidino)propyl]-1,4-diazepan-2-one Formula: C27H31N5O4 MolecularWeight: 489.56614

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCCN2CC(CN(CC2=O)C(=O)C3=NNC4=CC=CC=C43)OCC5=CC=CC=C5

Isomeric SMILES

C1CC(=O)N(C1)CCCN2CC(CN(CC2=O)C(=O)C3=NNC4=CC=CC=C43)OCC5=CC=CC=C5

InChI

InChI=1S/C27H31N5O4/c33-24-12-6-13-30(24)14-7-15-31-16-21(36-19-20-8-2-1-3-9-20)17-32(18-25(31)34)27(35)26-22-10-4-5-11-23(22)28-29-26/h1-5,8-11,21H,6-7,12-19H2,(H,28,29)