methyl 2-[4-(1,3-benzothiazol-5-ylcarbonyl)-2-oxidanylidene-piperazin-1-yl]ethanoate

Systemtic Name: methyl 2-[4-(1,3-benzothiazol-5-ylcarbonyl)-2-oxidanylidene-piperazin-1-yl]ethanoate Openeye Name: methyl 2-[4-(1,3-benzothiazole-5-carbonyl)-2-oxo-piperazin-1-yl]acetate CAS Name: 2-[4-[1,3-benzothiazol-5-yl(oxo)methyl]-2-oxo-1-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(1,3-benzothiazole-5-carbonyl)-2-oxopiperazin-1-yl]acetate Traditional Name: 2-[4-(1,3-benzothiazole-5-carbonyl)-2-keto-piperazino]acetic acid methyl ester Formula: C15H15N3O4S MolecularWeight: 333.3623

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1CCN(CC1=O)C(=O)C2=CC3=C(C=C2)SC=N3

Isomeric SMILES

COC(=O)CN1CCN(CC1=O)C(=O)C2=CC3=C(C=C2)SC=N3

InChI

InChI=1S/C15H15N3O4S/c1-22-14(20)8-17-4-5-18(7-13(17)19)15(21)10-2-3-12-11(6-10)16-9-23-12/h2-3,6,9H,4-5,7-8H2,1H3