6-chloranyl-N-[[1,6-diethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-3-methoxy-quinoxaline-2-carboxamide

Systemtic Name: 6-chloranyl-N-[[1,6-diethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-3-methoxy-quinoxaline-2-carboxamide Openeye Name: 6-chloro-N-[[1,6-diethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-3-methoxy-quinoxaline-2-carboxamide CAS Name: 6-chloro-N-[[1,6-diethyl-4-(4-oxanylamino)-5-pyrazolo[3,4-b]pyridinyl]methyl]-3-methoxy-2-quinoxalinecarboxamide IUPAC Name: 6-chloro-N-[[1,6-diethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-3-methoxyquinoxaline-2-carboxamide Traditional Name: 6-chloro-N-[[1,6-diethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-3-methoxy-quinoxaline-2-carboxamide Formula: C26H30ClN7O3 MolecularWeight: 524.0145

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C=NN(C2=N1)CC)NC3CCOCC3)CNC(=O)C4=NC5=C(C=C(C=C5)Cl)N=C4OC

Isomeric SMILES

CCC1=C(C(=C2C=NN(C2=N1)CC)NC3CCOCC3)CNC(=O)C4=NC5=C(C=C(C=C5)Cl)N=C4OC

InChI

InChI=1S/C26H30ClN7O3/c1-4-19-17(13-28-25(35)23-26(36-3)33-21-12-15(27)6-7-20(21)31-23)22(30-16-8-10-37-11-9-16)18-14-29-34(5-2)24(18)32-19/h6-7,12,14,16H,4-5,8-11,13H2,1-3H3,(H,28,35)(H,30,32)