(1S,4R)-4-methyl-1-oxidanylidene-2,3,4,5-tetrahydro-1$l^{4}-benzothiocin-6-one

Systemtic Name: (1S,4R)-4-methyl-1-oxidanylidene-2,3,4,5-tetrahydro-1$l^{4}-benzothiocin-6-one Openeye Name: (1S,4R)-4-methyl-1-oxo-2,3,4,5-tetrahydro-1$l^{4}-benzothiocin-6-one CAS Name: (1S,4R)-4-methyl-1-oxo-2,3,4,5-tetrahydro-1$l^{4}-benzothiocin-6-one IUPAC Name: (1S,4R)-4-methyl-1-oxo-2,3,4,5-tetrahydro-1$l^{4}-benzothiocin-6-one Traditional Name: (1S,4R)-1-keto-4-methyl-2,3,4,5-tetrahydro-1$l^{4}-benzothiocin-6-one Formula: C12H14O2S MolecularWeight: 222.30336

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCS(=O)C2=CC=CC=C2C(=O)C1

Isomeric SMILES

C[C@H]1CC[S@](=O)C2=CC=CC=C2C(=O)C1

InChI

InChI=1S/C12H14O2S/c1-9-6-7-15(14)12-5-3-2-4-10(12)11(13)8-9/h2-5,9H,6-8H2,1H3/t9-,15-/m0/s1