1-cyclohexyl-6-phenylmethoxy-4-(3-pyrazin-2-ylpropanoyl)-1,4-diazepan-2-one

Systemtic Name: 1-cyclohexyl-6-phenylmethoxy-4-(3-pyrazin-2-ylpropanoyl)-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-1-cyclohexyl-4-(3-pyrazin-2-ylpropanoyl)-1,4-diazepan-2-one CAS Name: 1-cyclohexyl-4-[1-oxo-3-(2-pyrazinyl)propyl]-6-phenylmethoxy-1,4-diazepan-2-one IUPAC Name: 1-cyclohexyl-6-phenylmethoxy-4-(3-pyrazin-2-ylpropanoyl)-1,4-diazepan-2-one Traditional Name: 6-benzoxy-1-cyclohexyl-4-(3-pyrazin-2-ylpropanoyl)-1,4-diazepan-2-one Formula: C25H32N4O3 MolecularWeight: 436.54658

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)CCC3=NC=CN=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)CCC3=NC=CN=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C25H32N4O3/c30-24(12-11-21-15-26-13-14-27-21)28-16-23(32-19-20-7-3-1-4-8-20)17-29(25(31)18-28)22-9-5-2-6-10-22/h1,3-4,7-8,13-15,22-23H,2,5-6,9-12,16-19H2