ethyl 4-[3-[(2-methyl-3-oxidanylidene-4H-1,4-benzothiazin-6-yl)sulfonyl]propanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[3-[(2-methyl-3-oxidanylidene-4H-1,4-benzothiazin-6-yl)sulfonyl]propanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[3-[(2-methyl-3-oxo-4H-1,4-benzothiazin-6-yl)sulfonyl]propanoylamino]piperidine-1-carboxylate CAS Name: 4-[[3-[(2-methyl-3-oxo-4H-1,4-benzothiazin-6-yl)sulfonyl]-1-oxopropyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[(2-methyl-3-oxo-4H-1,4-benzothiazin-6-yl)sulfonyl]propanoylamino]piperidine-1-carboxylate Traditional Name: 4-[3-[(3-keto-2-methyl-4H-1,4-benzothiazin-6-yl)sulfonyl]propanoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C20H27N3O6S2 MolecularWeight: 469.57488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CCS(=O)(=O)C2=CC3=C(C=C2)SC(C(=O)N3)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CCS(=O)(=O)C2=CC3=C(C=C2)SC(C(=O)N3)C

InChI

InChI=1S/C20H27N3O6S2/c1-3-29-20(26)23-9-6-14(7-10-23)21-18(24)8-11-31(27,28)15-4-5-17-16(12-15)22-19(25)13(2)30-17/h4-5,12-14H,3,6-11H2,1-2H3,(H,21,24)(H,22,25)