ethyl 4-[2-(4H-3,1-benzothiazin-2-ylsulfanyl)ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(4H-3,1-benzothiazin-2-ylsulfanyl)ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(4H-3,1-benzothiazin-2-ylsulfanyl)acetyl]piperazine-1-carboxylate CAS Name: 4-[2-(4H-3,1-benzothiazin-2-ylthio)-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(4H-3,1-benzothiazin-2-ylsulfanyl)acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(4H-3,1-benzothiazin-2-ylthio)acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H21N3O3S2 MolecularWeight: 379.49694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CSC2=NC3=CC=CC=C3CS2

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CSC2=NC3=CC=CC=C3CS2

InChI

InChI=1S/C17H21N3O3S2/c1-2-23-17(22)20-9-7-19(8-10-20)15(21)12-25-16-18-14-6-4-3-5-13(14)11-24-16/h3-6H,2,7-12H2,1H3