1-methyl-5-[[4-(phenylmethyl)-1,4-diazepan-1-yl]carbonyl]pyrimidine-2,4-dione

Systemtic Name: 1-methyl-5-[[4-(phenylmethyl)-1,4-diazepan-1-yl]carbonyl]pyrimidine-2,4-dione Openeye Name: 5-(4-benzyl-1,4-diazepane-1-carbonyl)-1-methyl-pyrimidine-2,4-dione CAS Name: 1-methyl-5-[oxo-[4-(phenylmethyl)-1,4-diazepan-1-yl]methyl]pyrimidine-2,4-dione IUPAC Name: 5-(4-benzyl-1,4-diazepane-1-carbonyl)-1-methylpyrimidine-2,4-dione Traditional Name: 5-(4-benzyl-1,4-diazepane-1-carbonyl)-1-methyl-pyrimidine-2,4-quinone Formula: C18H22N4O3 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)NC1=O)C(=O)N2CCCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CN1C=C(C(=O)NC1=O)C(=O)N2CCCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C18H22N4O3/c1-20-13-15(16(23)19-18(20)25)17(24)22-9-5-8-21(10-11-22)12-14-6-3-2-4-7-14/h2-4,6-7,13H,5,8-12H2,1H3,(H,19,23,25)