6-[2-(3-tert-butyl-4-oxidanyl-phenyl)ethyl]-6-cyclopentyl-3-[(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]oxane-2,4-dione

Systemtic Name: 6-[2-(3-tert-butyl-4-oxidanyl-phenyl)ethyl]-6-cyclopentyl-3-[(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]oxane-2,4-dione Openeye Name: 6-[2-(3-tert-butyl-4-hydroxy-phenyl)ethyl]-6-cyclopentyl-3-[(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]tetrahydropyran-2,4-dione CAS Name: 6-[2-(3-tert-butyl-4-hydroxyphenyl)ethyl]-6-cyclopentyl-3-[(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]oxane-2,4-dione IUPAC Name: 6-[2-(3-tert-butyl-4-hydroxyphenyl)ethyl]-6-cyclopentyl-3-[(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]oxane-2,4-dione Traditional Name: 6-[2-(3-tert-butyl-4-hydroxy-phenyl)ethyl]-6-cyclopentyl-3-[(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]tetrahydropyran-2,4-quinone Formula: C30H38N4O4 MolecularWeight: 518.64712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=NC(=NN12)CC3C(=O)CC(OC3=O)(CCC4=CC(=C(C=C4)O)C(C)(C)C)C5CCCC5)C

Isomeric SMILES

CC1=CC(=NC2=NC(=NN12)CC3C(=O)CC(OC3=O)(CCC4=CC(=C(C=C4)O)C(C)(C)C)C5CCCC5)C

InChI

InChI=1S/C30H38N4O4/c1-18-14-19(2)34-28(31-18)32-26(33-34)16-22-25(36)17-30(38-27(22)37,21-8-6-7-9-21)13-12-20-10-11-24(35)23(15-20)29(3,4)5/h10-11,14-15,21-22,35H,6-9,12-13,16-17H2,1-5H3