[(2S)-1-(dimethylamino)-1-oxidanylidene-propan-2-yl] thieno[3,2-b][1]benzothiole-2-carboxylate

Systemtic Name: [(2S)-1-(dimethylamino)-1-oxidanylidene-propan-2-yl] thieno[3,2-b][1]benzothiole-2-carboxylate Openeye Name: [(1S)-2-(dimethylamino)-1-methyl-2-oxo-ethyl] thieno[3,2-b]benzothiophene-2-carboxylate CAS Name: 2-thieno[3,2-b][1]benzothiolecarboxylic acid [(2S)-1-(dimethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(dimethylamino)-1-oxopropan-2-yl] thieno[3,2-b][1]benzothiole-2-carboxylate Traditional Name: thieno[3,2-b]benzothiophene-2-carboxylic acid [(1S)-2-(dimethylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H15NO3S2 MolecularWeight: 333.4252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C)OC(=O)C1=CC2=C(S1)C3=CC=CC=C3S2

Isomeric SMILES

C[C@@H](C(=O)N(C)C)OC(=O)C1=CC2=C(S1)C3=CC=CC=C3S2

InChI

InChI=1S/C16H15NO3S2/c1-9(15(18)17(2)3)20-16(19)13-8-12-14(22-13)10-6-4-5-7-11(10)21-12/h4-9H,1-3H3/t9-/m0/s1