6-(4-methylphenyl)sulfonyl-3-(phenylmethylsulfanyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-7-one

Systemtic Name: 6-(4-methylphenyl)sulfonyl-3-(phenylmethylsulfanyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-7-one Openeye Name: 3-benzylsulfanyl-6-(p-tolylsulfonyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-7-one CAS Name: 6-(4-methylphenyl)sulfonyl-3-(phenylmethylthio)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-7-one IUPAC Name: 3-benzylsulfanyl-6-(4-methylphenyl)sulfonyl-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-7-one Traditional Name: 3-(benzylthio)-6-tosyl-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-7-one Formula: C18H16N2O3S3 MolecularWeight: 404.52624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3C(C2=O)N=C(S3)SCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C3C(C2=O)N=C(S3)SCC4=CC=CC=C4

InChI

InChI=1S/C18H16N2O3S3/c1-12-7-9-14(10-8-12)26(22,23)20-16(21)15-17(20)25-18(19-15)24-11-13-5-3-2-4-6-13/h2-10,15,17H,11H2,1H3