1-[4-(4-tert-butylphenyl)sulfanyl-2,5-dimethyl-phenyl]-3-methyl-1,3,5-triazinane-2,4,6-trione

Systemtic Name: 1-[4-(4-tert-butylphenyl)sulfanyl-2,5-dimethyl-phenyl]-3-methyl-1,3,5-triazinane-2,4,6-trione Openeye Name: 1-[4-(4-tert-butylphenyl)sulfanyl-2,5-dimethyl-phenyl]-3-methyl-1,3,5-triazinane-2,4,6-trione CAS Name: 1-[4-[(4-tert-butylphenyl)thio]-2,5-dimethylphenyl]-3-methyl-1,3,5-triazinane-2,4,6-trione IUPAC Name: 1-[4-(4-tert-butylphenyl)sulfanyl-2,5-dimethylphenyl]-3-methyl-1,3,5-triazinane-2,4,6-trione Traditional Name: 1-[4-[(4-tert-butylphenyl)thio]-2,5-dimethyl-phenyl]-3-methyl-isocyanuric acid Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1SC2=CC=C(C=C2)C(C)(C)C)C)N3C(=O)NC(=O)N(C3=O)C

Isomeric SMILES

CC1=CC(=C(C=C1SC2=CC=C(C=C2)C(C)(C)C)C)N3C(=O)NC(=O)N(C3=O)C

InChI

InChI=1S/C22H25N3O3S/c1-13-12-18(29-16-9-7-15(8-10-16)22(3,4)5)14(2)11-17(13)25-20(27)23-19(26)24(6)21(25)28/h7-12H,1-6H3,(H,23,26,27)