N-[[4-[(2-azanyl-7H-purin-6-yl)oxymethyl]phenyl]methyl]-7-(diethylamino)-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: N-[[4-[(2-azanyl-7H-purin-6-yl)oxymethyl]phenyl]methyl]-7-(diethylamino)-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-[[4-[(2-amino-7H-purin-6-yl)oxymethyl]phenyl]methyl]-7-(diethylamino)-2-oxo-chromene-3-carboxamide CAS Name: N-[[4-[(2-amino-7H-purin-6-yl)oxymethyl]phenyl]methyl]-7-(diethylamino)-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-[[4-[(2-amino-7H-purin-6-yl)oxymethyl]phenyl]methyl]-7-(diethylamino)-2-oxochromene-3-carboxamide Traditional Name: N-[4-[(2-amino-7H-purin-6-yl)oxymethyl]benzyl]-7-(diethylamino)-2-keto-chromene-3-carboxamide Formula: C27H27N7O4 MolecularWeight: 513.54778

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)NCC3=CC=C(C=C3)COC4=NC(=NC5=C4NC=N5)N

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)NCC3=CC=C(C=C3)COC4=NC(=NC5=C4NC=N5)N

InChI

InChI=1S/C27H27N7O4/c1-3-34(4-2)19-10-9-18-11-20(26(36)38-21(18)12-19)24(35)29-13-16-5-7-17(8-6-16)14-37-25-22-23(31-15-30-22)32-27(28)33-25/h5-12,15H,3-4,13-14H2,1-2H3,(H,29,35)(H3,28,30,31,32,33)