5-[[6-[2,6-bis(chloranyl)phenyl]-7-(tert-butylcarbamoylamino)pyrido[2,3-d]pyrimidin-2-yl]amino]-1,3-benzodioxole-2,2-dicarboxamide

Systemtic Name: 5-[[6-[2,6-bis(chloranyl)phenyl]-7-(tert-butylcarbamoylamino)pyrido[2,3-d]pyrimidin-2-yl]amino]-1,3-benzodioxole-2,2-dicarboxamide Openeye Name: 5-[[7-(tert-butylcarbamoylamino)-6-(2,6-dichlorophenyl)pyrido[2,3-d]pyrimidin-2-yl]amino]-1,3-benzodioxole-2,2-dicarboxamide CAS Name: 5-[[7-[[(tert-butylamino)-oxomethyl]amino]-6-(2,6-dichlorophenyl)-2-pyrido[2,3-d]pyrimidinyl]amino]-1,3-benzodioxole-2,2-dicarboxamide IUPAC Name: 5-[[7-(tert-butylcarbamoylamino)-6-(2,6-dichlorophenyl)pyrido[2,3-d]pyrimidin-2-yl]amino]-1,3-benzodioxole-2,2-dicarboxamide Traditional Name: 5-[[7-(tert-butylcarbamoylamino)-6-(2,6-dichlorophenyl)pyrido[2,3-d]pyrimidin-2-yl]amino]-1,3-benzodioxole-2,2-dicarboxamide Formula: C27H24Cl2N8O5 MolecularWeight: 611.43606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC1=C(C=C2C=NC(=NC2=N1)NC3=CC4=C(C=C3)OC(O4)(C(=O)N)C(=O)N)C5=C(C=CC=C5Cl)Cl

Isomeric SMILES

CC(C)(C)NC(=O)NC1=C(C=C2C=NC(=NC2=N1)NC3=CC4=C(C=C3)OC(O4)(C(=O)N)C(=O)N)C5=C(C=CC=C5Cl)Cl

InChI

InChI=1S/C27H24Cl2N8O5/c1-26(2,3)37-25(40)36-21-14(19-15(28)5-4-6-16(19)29)9-12-11-32-24(35-20(12)34-21)33-13-7-8-17-18(10-13)42-27(41-17,22(30)38)23(31)39/h4-11H,1-3H3,(H2,30,38)(H2,31,39)(H3,32,33,34,35,36,37,40)