6-methyl-3-(phenylmethyl)-1-sulfanyl-1,3,5-triazinane-2,4-dione

Systemtic Name: 6-methyl-3-(phenylmethyl)-1-sulfanyl-1,3,5-triazinane-2,4-dione Openeye Name: 3-benzyl-6-methyl-1-sulfanyl-1,3,5-triazinane-2,4-dione CAS Name: 1-mercapto-6-methyl-3-(phenylmethyl)-1,3,5-triazinane-2,4-dione IUPAC Name: 3-benzyl-6-methyl-1-sulfanyl-1,3,5-triazinane-2,4-dione Traditional Name: 3-benzyl-1-mercapto-6-methyl-1,3,5-triazinane-2,4-quinone Formula: C11H13N3O2S MolecularWeight: 251.30482

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Descriptors Computed from Structure

Canonical SMILES:

CC1NC(=O)N(C(=O)N1S)CC2=CC=CC=C2

Isomeric SMILES

CC1NC(=O)N(C(=O)N1S)CC2=CC=CC=C2

InChI

InChI=1S/C11H13N3O2S/c1-8-12-10(15)13(11(16)14(8)17)7-9-5-3-2-4-6-9/h2-6,8,17H,7H2,1H3,(H,12,15)