3-[7-[2,6-dimethyl-4-(2-morpholin-4-ylethoxy)phenyl]-9-methyl-8-oxidanylidene-purin-2-yl]sulfonyl-N-methoxy-4-methyl-benzamide

Systemtic Name: 3-[7-[2,6-dimethyl-4-(2-morpholin-4-ylethoxy)phenyl]-9-methyl-8-oxidanylidene-purin-2-yl]sulfonyl-N-methoxy-4-methyl-benzamide Openeye Name: 3-[7-[2,6-dimethyl-4-(2-morpholinoethoxy)phenyl]-9-methyl-8-oxo-purin-2-yl]sulfonyl-N-methoxy-4-methyl-benzamide CAS Name: 3-[[7-[2,6-dimethyl-4-[2-(4-morpholinyl)ethoxy]phenyl]-9-methyl-8-oxo-2-purinyl]sulfonyl]-N-methoxy-4-methylbenzamide IUPAC Name: 3-[7-[2,6-dimethyl-4-(2-morpholin-4-ylethoxy)phenyl]-9-methyl-8-oxopurin-2-yl]sulfonyl-N-methoxy-4-methylbenzamide Traditional Name: 3-[7-[2,6-dimethyl-4-(2-morpholinoethoxy)phenyl]-8-keto-9-methyl-purin-2-yl]sulfonyl-N-methoxy-4-methyl-benzamide Formula: C29H34N6O7S MolecularWeight: 610.68126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NOC)S(=O)(=O)C2=NC=C3C(=N2)N(C(=O)N3C4=C(C=C(C=C4C)OCCN5CCOCC5)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NOC)S(=O)(=O)C2=NC=C3C(=N2)N(C(=O)N3C4=C(C=C(C=C4C)OCCN5CCOCC5)C)C

InChI

InChI=1S/C29H34N6O7S/c1-18-6-7-21(27(36)32-40-5)16-24(18)43(38,39)28-30-17-23-26(31-28)33(4)29(37)35(23)25-19(2)14-22(15-20(25)3)42-13-10-34-8-11-41-12-9-34/h6-7,14-17H,8-13H2,1-5H3,(H,32,36)