N-[4-(pyridin-2-ylmethylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide

Systemtic Name: N-[4-(pyridin-2-ylmethylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[4-(2-pyridylmethylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[4-[oxo-(2-pyridinylmethylamino)methyl]phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[4-(pyridin-2-ylmethylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[4-(2-pyridylmethylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC=C(O1)C(=O)NC2=CC=C(C=C2)C(=O)NCC3=CC=CC=N3

Isomeric SMILES

C1CSC=C(O1)C(=O)NC2=CC=C(C=C2)C(=O)NCC3=CC=CC=N3

InChI

InChI=1S/C18H17N3O3S/c22-17(20-11-15-3-1-2-8-19-15)13-4-6-14(7-5-13)21-18(23)16-12-25-10-9-24-16/h1-8,12H,9-11H2,(H,20,22)(H,21,23)