6-methyl-5-phenyl-2-sulfanylidene-1,3-diazabicyclo[3.2.1]octane-4,8-dione

Systemtic Name: 6-methyl-5-phenyl-2-sulfanylidene-1,3-diazabicyclo[3.2.1]octane-4,8-dione Openeye Name: 6-methyl-5-phenyl-2-thioxo-1,3-diazabicyclo[3.2.1]octane-4,8-dione CAS Name: 6-methyl-5-phenyl-2-sulfanylidene-1,3-diazabicyclo[3.2.1]octane-4,8-dione IUPAC Name: 6-methyl-5-phenyl-2-sulfanylidene-1,3-diazabicyclo[3.2.1]octane-4,8-dione Traditional Name: 6-methyl-5-phenyl-2-thioxo-1,3-diazabicyclo[3.2.1]octane-4,8-quinone Formula: C13H12N2O2S MolecularWeight: 260.31158

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN2C(=O)C1(C(=O)NC2=S)C3=CC=CC=C3

Isomeric SMILES

CC1CN2C(=O)C1(C(=O)NC2=S)C3=CC=CC=C3

InChI

InChI=1S/C13H12N2O2S/c1-8-7-15-11(17)13(8,10(16)14-12(15)18)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,14,16,18)