N-[5-(cyclooctylcarbamoyl)-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide

Systemtic Name: N-[5-(cyclooctylcarbamoyl)-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[5-(cyclooctylcarbamoyl)-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[5-[(cyclooctylamino)-oxomethyl]-2-methylphenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[5-(cyclooctylcarbamoyl)-2-methylphenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[5-(cyclooctylcarbamoyl)-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CCCCCCC2)NC(=O)C3=CSCCO3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CCCCCCC2)NC(=O)C3=CSCCO3

InChI

InChI=1S/C21H28N2O3S/c1-15-9-10-16(20(24)22-17-7-5-3-2-4-6-8-17)13-18(15)23-21(25)19-14-27-12-11-26-19/h9-10,13-14,17H,2-8,11-12H2,1H3,(H,22,24)(H,23,25)