6-azanyl-5-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl-propyl-amino]-1-(phenylmethyl)pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl-propyl-amino]-1-(phenylmethyl)pyrimidine-2,4-dione Openeye Name: 6-amino-1-benzyl-5-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl-propyl-amino]pyrimidine-2,4-dione CAS Name: 6-amino-5-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl-propylamino]-1-(phenylmethyl)pyrimidine-2,4-dione IUPAC Name: 6-amino-1-benzyl-5-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl-propylamino]pyrimidine-2,4-dione Traditional Name: 6-amino-1-benzyl-5-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl-propyl-amino]pyrimidine-2,4-quinone Formula: C24H27ClN4O4 MolecularWeight: 470.94858

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC2=C(C(=C1)Cl)OCCCO2)C3=C(N(C(=O)NC3=O)CC4=CC=CC=C4)N

Isomeric SMILES

CCCN(CC1=CC2=C(C(=C1)Cl)OCCCO2)C3=C(N(C(=O)NC3=O)CC4=CC=CC=C4)N

InChI

InChI=1S/C24H27ClN4O4/c1-2-9-28(14-17-12-18(25)21-19(13-17)32-10-6-11-33-21)20-22(26)29(24(31)27-23(20)30)15-16-7-4-3-5-8-16/h3-5,7-8,12-13H,2,6,9-11,14-15,26H2,1H3,(H,27,30,31)