6-azanyl-1,3-dimethyl-5-[2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanoyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-1,3-dimethyl-5-[2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanoyl]pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-(4-benzyl-1,4-diazepan-1-yl)acetyl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 6-amino-1,3-dimethyl-5-[1-oxo-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-(4-benzyl-1,4-diazepan-1-yl)acetyl]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-(4-benzyl-1,4-diazepan-1-yl)acetyl]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C20H27N5O3 MolecularWeight: 385.46008

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)C(=O)CN2CCCN(CC2)CC3=CC=CC=C3)N

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)C(=O)CN2CCCN(CC2)CC3=CC=CC=C3)N

InChI

InChI=1S/C20H27N5O3/c1-22-18(21)17(19(27)23(2)20(22)28)16(26)14-25-10-6-9-24(11-12-25)13-15-7-4-3-5-8-15/h3-5,7-8H,6,9-14,21H2,1-2H3