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

Systemtic Name: N-[2-chloranyl-4-(cycloheptylcarbamoyl)-5-methoxy-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[2-chloro-4-(cycloheptylcarbamoyl)-5-methoxy-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[2-chloro-4-[(cycloheptylamino)-oxomethyl]-5-methoxyphenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[2-chloro-4-(cycloheptylcarbamoyl)-5-methoxyphenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[2-chloro-4-(cycloheptylcarbamoyl)-5-methoxy-phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C20H25ClN2O4S MolecularWeight: 424.9415

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NC2CCCCCC2)Cl)NC(=O)C3=CSCCO3

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NC2CCCCCC2)Cl)NC(=O)C3=CSCCO3

InChI

InChI=1S/C20H25ClN2O4S/c1-26-17-11-16(23-20(25)18-12-28-9-8-27-18)15(21)10-14(17)19(24)22-13-6-4-2-3-5-7-13/h10-13H,2-9H2,1H3,(H,22,24)(H,23,25)