(4-oxidanylidene-5H-1,5-benzothiazepin-2-yl) dimethylaminosulfanylmethanoate

Systemtic Name: (4-oxidanylidene-5H-1,5-benzothiazepin-2-yl) dimethylaminosulfanylmethanoate Openeye Name: (4-oxo-5H-1,5-benzothiazepin-2-yl) dimethylaminosulfanylformate CAS Name: (dimethylaminothio)formic acid (4-oxo-5H-1,5-benzothiazepin-2-yl) ester IUPAC Name: (4-oxo-5H-1,5-benzothiazepin-2-yl) dimethylaminosulfanylformate Traditional Name: (dimethylaminothio)formic acid (4-keto-5H-1,5-benzothiazepin-2-yl) ester Formula: C12H12N2O3S2 MolecularWeight: 296.36528

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)SC(=O)OC1=CC(=O)NC2=CC=CC=C2S1

Isomeric SMILES

CN(C)SC(=O)OC1=CC(=O)NC2=CC=CC=C2S1

InChI

InChI=1S/C12H12N2O3S2/c1-14(2)19-12(16)17-11-7-10(15)13-8-5-3-4-6-9(8)18-11/h3-7H,1-2H3,(H,13,15)