1-[4-(2,3-dihydro-1,4-oxathiin-6-ylcarbonylamino)phenyl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[4-(2,3-dihydro-1,4-oxathiin-6-ylcarbonylamino)phenyl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[4-(2,3-dihydro-1,4-oxathiine-6-carbonylamino)benzoyl]piperidine-4-carboxamide CAS Name: 1-[[4-[[2,3-dihydro-1,4-oxathiin-6-yl(oxo)methyl]amino]phenyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[4-(2,3-dihydro-1,4-oxathiine-6-carbonylamino)benzoyl]piperidine-4-carboxamide Traditional Name: 1-[4-(2,3-dihydro-1,4-oxathiin-6-carbonylamino)benzoyl]isonipecotamide Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)C2=CC=C(C=C2)NC(=O)C3=CSCCO3

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)C2=CC=C(C=C2)NC(=O)C3=CSCCO3

InChI

InChI=1S/C18H21N3O4S/c19-16(22)12-5-7-21(8-6-12)18(24)13-1-3-14(4-2-13)20-17(23)15-11-26-10-9-25-15/h1-4,11-12H,5-10H2,(H2,19,22)(H,20,23)