N-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-propyl-propanamide

Systemtic Name: N-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-propyl-propanamide Openeye Name: N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-3-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)-N-propyl-propanamide CAS Name: N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-3-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-N-propylpropanamide IUPAC Name: N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-3-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)-N-propylpropanamide Traditional Name: N-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl]-3-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)-N-propyl-propionamide Formula: C21H22ClN7O3 MolecularWeight: 455.89748

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)CCN3C=NC4=C(C3=O)C=NN4C

Isomeric SMILES

CCCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)CCN3C=NC4=C(C3=O)C=NN4C

InChI

InChI=1S/C21H22ClN7O3/c1-3-7-28(11-17-25-16-9-13(22)4-5-14(16)20(31)26-17)18(30)6-8-29-12-23-19-15(21(29)32)10-24-27(19)2/h4-5,9-10,12H,3,6-8,11H2,1-2H3,(H,25,26,31)