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

Systemtic Name: N-[4-(3-methylbutylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[4-(isopentylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[4-[(3-methylbutylamino)-oxomethyl]phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[4-(3-methylbutylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[4-(isoamylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C17H22N2O3S MolecularWeight: 334.43318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CC=C(C=C1)NC(=O)C2=CSCCO2

Isomeric SMILES

CC(C)CCNC(=O)C1=CC=C(C=C1)NC(=O)C2=CSCCO2

InChI

InChI=1S/C17H22N2O3S/c1-12(2)7-8-18-16(20)13-3-5-14(6-4-13)19-17(21)15-11-23-10-9-22-15/h3-6,11-12H,7-10H2,1-2H3,(H,18,20)(H,19,21)