3-[4-(1-adamantyl)phenyl]-5-[(3-methyl-1-naphthalen-1-yl-5-oxidanylidene-pyrazol-4-ylidene)methyl]-6-oxidanyl-1,3-diazinane-2,4-dione

Systemtic Name: 3-[4-(1-adamantyl)phenyl]-5-[(3-methyl-1-naphthalen-1-yl-5-oxidanylidene-pyrazol-4-ylidene)methyl]-6-oxidanyl-1,3-diazinane-2,4-dione Openeye Name: 3-[4-(1-adamantyl)phenyl]-6-hydroxy-5-[[3-methyl-1-(1-naphthyl)-5-oxo-pyrazol-4-ylidene]methyl]hexahydropyrimidine-2,4-dione CAS Name: 3-[4-(1-adamantyl)phenyl]-6-hydroxy-5-[[3-methyl-1-(1-naphthalenyl)-5-oxo-4-pyrazolylidene]methyl]-1,3-diazinane-2,4-dione IUPAC Name: 3-[4-(1-adamantyl)phenyl]-6-hydroxy-5-[(3-methyl-1-naphthalen-1-yl-5-oxopyrazol-4-ylidene)methyl]-1,3-diazinane-2,4-dione Traditional Name: 3-[4-(1-adamantyl)phenyl]-6-hydroxy-5-[[5-keto-3-methyl-1-(1-naphthyl)-2-pyrazolin-4-ylidene]methyl]-5,6-dihydrouracil Formula: C35H34N4O4 MolecularWeight: 574.66886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2C(NC(=O)N(C2=O)C3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5)O)C7=CC=CC8=CC=CC=C87

Isomeric SMILES

CC1=NN(C(=O)C1=CC2C(NC(=O)N(C2=O)C3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5)O)C7=CC=CC8=CC=CC=C87

InChI

InChI=1S/C35H34N4O4/c1-20-28(33(42)39(37-20)30-8-4-6-24-5-2-3-7-27(24)30)16-29-31(40)36-34(43)38(32(29)41)26-11-9-25(10-12-26)35-17-21-13-22(18-35)15-23(14-21)19-35/h2-12,16,21-23,29,31,40H,13-15,17-19H2,1H3,(H,36,43)