6-azanyl-5-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propanoyl]-1,3-dimethyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propanoyl]-1,3-dimethyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propanoyl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-1-oxopropyl]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propanoyl]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propanoyl]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C18H22N4O5 MolecularWeight: 374.39108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=C(N(C(=O)N(C1=O)C)C)N)NC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC(C(=O)C1=C(N(C(=O)N(C1=O)C)C)N)NC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C18H22N4O5/c1-10(15(23)14-16(19)21(2)18(25)22(3)17(14)24)20-11-5-6-12-13(9-11)27-8-4-7-26-12/h5-6,9-10,20H,4,7-8,19H2,1-3H3