6-azanyl-1-cyclopropyl-5-[2-[2-(4-methoxyphenyl)azepan-1-yl]ethanoyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-1-cyclopropyl-5-[2-[2-(4-methoxyphenyl)azepan-1-yl]ethanoyl]pyrimidine-2,4-dione Openeye Name: 6-amino-1-cyclopropyl-5-[2-[2-(4-methoxyphenyl)azepan-1-yl]acetyl]pyrimidine-2,4-dione CAS Name: 6-amino-1-cyclopropyl-5-[2-[2-(4-methoxyphenyl)-1-azepanyl]-1-oxoethyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-1-cyclopropyl-5-[2-[2-(4-methoxyphenyl)azepan-1-yl]acetyl]pyrimidine-2,4-dione Traditional Name: 6-amino-1-cyclopropyl-5-[2-[2-(4-methoxyphenyl)azepan-1-yl]acetyl]pyrimidine-2,4-quinone Formula: C22H28N4O4 MolecularWeight: 412.48212

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2CC(=O)C3=C(N(C(=O)NC3=O)C4CC4)N

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCCCN2CC(=O)C3=C(N(C(=O)NC3=O)C4CC4)N

InChI

InChI=1S/C22H28N4O4/c1-30-16-10-6-14(7-11-16)17-5-3-2-4-12-25(17)13-18(27)19-20(23)26(15-8-9-15)22(29)24-21(19)28/h6-7,10-11,15,17H,2-5,8-9,12-13,23H2,1H3,(H,24,28,29)