N-[2-chloranyl-5-methoxy-4-(pyridin-2-ylmethylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide

Systemtic Name: N-[2-chloranyl-5-methoxy-4-(pyridin-2-ylmethylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[2-chloro-5-methoxy-4-(2-pyridylmethylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[2-chloro-5-methoxy-4-[oxo-(2-pyridinylmethylamino)methyl]phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[2-chloro-5-methoxy-4-(pyridin-2-ylmethylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[2-chloro-5-methoxy-4-(2-pyridylmethylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C19H18ClN3O4S MolecularWeight: 419.88192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NCC2=CC=CC=N2)Cl)NC(=O)C3=CSCCO3

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NCC2=CC=CC=N2)Cl)NC(=O)C3=CSCCO3

InChI

InChI=1S/C19H18ClN3O4S/c1-26-16-9-15(23-19(25)17-11-28-7-6-27-17)14(20)8-13(16)18(24)22-10-12-4-2-3-5-21-12/h2-5,8-9,11H,6-7,10H2,1H3,(H,22,24)(H,23,25)