methyl 1-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxo-acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-1,2-dioxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxoacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-keto-acetyl]isonipecotic acid methyl ester Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(=O)N3CCC(CC3)C(=O)OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(=O)N3CCC(CC3)C(=O)OC

InChI

InChI=1S/C18H21N3O5S/c1-3-26-12-4-5-13-14(10-12)27-18(19-13)20-15(22)16(23)21-8-6-11(7-9-21)17(24)25-2/h4-5,10-11H,3,6-9H2,1-2H3,(H,19,20,22)