1-[(1S)-1-phenylethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-[(1S)-1-phenylethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-[(1S)-1-phenylethyl]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-[(1S)-1-phenylethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-[(1S)-1-phenylethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-[(1S)-1-phenylethyl]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C12H12N2O2S MolecularWeight: 248.30088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C(=O)CC(=O)NC2=S

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)N2C(=O)CC(=O)NC2=S

InChI

InChI=1S/C12H12N2O2S/c1-8(9-5-3-2-4-6-9)14-11(16)7-10(15)13-12(14)17/h2-6,8H,7H2,1H3,(H,13,15,17)/t8-/m0/s1