3-[2,6-bis(chloranyl)phenyl]-1-(2-hydroxyethyl)-7-[[4-[4-(2-methoxyethanoyl)piperazin-1-yl]phenyl]amino]pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 3-[2,6-bis(chloranyl)phenyl]-1-(2-hydroxyethyl)-7-[[4-[4-(2-methoxyethanoyl)piperazin-1-yl]phenyl]amino]pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 3-(2,6-dichlorophenyl)-1-(2-hydroxyethyl)-7-[4-[4-(2-methoxyacetyl)piperazin-1-yl]anilino]pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 3-(2,6-dichlorophenyl)-1-(2-hydroxyethyl)-7-[4-[4-(2-methoxy-1-oxoethyl)-1-piperazinyl]anilino]pyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 3-(2,6-dichlorophenyl)-1-(2-hydroxyethyl)-7-[4-[4-(2-methoxyacetyl)piperazin-1-yl]anilino]pyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 3-(2,6-dichlorophenyl)-1-(2-hydroxyethyl)-7-[4-[4-(2-methoxyacetyl)piperazino]anilino]pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C27H27Cl2N7O5 MolecularWeight: 600.45318

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C4C(=N3)N(C(=O)N(C4=O)C5=C(C=CC=C5Cl)Cl)CCO

Isomeric SMILES

COCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C4C(=N3)N(C(=O)N(C4=O)C5=C(C=CC=C5Cl)Cl)CCO

InChI

InChI=1S/C27H27Cl2N7O5/c1-41-16-22(38)34-11-9-33(10-12-34)18-7-5-17(6-8-18)31-26-30-15-19-24(32-26)35(13-14-37)27(40)36(25(19)39)23-20(28)3-2-4-21(23)29/h2-8,15,37H,9-14,16H2,1H3,(H,30,31,32)