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

Systemtic Name: 6-azanyl-5-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl-methyl-amino]-1-(phenylmethyl)pyrimidine-2,4-dione Openeye Name: 6-amino-1-benzyl-5-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl-methyl-amino]pyrimidine-2,4-dione CAS Name: 6-amino-5-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl-methylamino]-1-(phenylmethyl)pyrimidine-2,4-dione IUPAC Name: 6-amino-1-benzyl-5-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl-methylamino]pyrimidine-2,4-dione Traditional Name: 6-amino-1-benzyl-5-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl-methyl-amino]pyrimidine-2,4-quinone Formula: C21H21ClN4O4 MolecularWeight: 428.86884

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C2C(=CC(=C1)Cl)COCO2)C3=C(N(C(=O)NC3=O)CC4=CC=CC=C4)N

Isomeric SMILES

CN(CC1=C2C(=CC(=C1)Cl)COCO2)C3=C(N(C(=O)NC3=O)CC4=CC=CC=C4)N

InChI

InChI=1S/C21H21ClN4O4/c1-25(10-14-7-16(22)8-15-11-29-12-30-18(14)15)17-19(23)26(21(28)24-20(17)27)9-13-5-3-2-4-6-13/h2-8H,9-12,23H2,1H3,(H,24,27,28)