N-[1,1-bis(oxidanyl)thiolan-3-yl]-N-[(4-chlorophenyl)methyl]-3-methyl-1-benzofuran-2-carboxamide

Systemtic Name: N-[1,1-bis(oxidanyl)thiolan-3-yl]-N-[(4-chlorophenyl)methyl]-3-methyl-1-benzofuran-2-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-N-(1,1-dihydroxythiolan-3-yl)-3-methyl-benzofuran-2-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-N-(1,1-dihydroxy-3-thiolanyl)-3-methyl-2-benzofurancarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-N-(1,1-dihydroxythiolan-3-yl)-3-methyl-1-benzofuran-2-carboxamide Traditional Name: N-(4-chlorobenzyl)-N-(1,1-dihydroxythiolan-3-yl)-3-methyl-coumarilamide Formula: C21H22ClNO4S MolecularWeight: 419.92168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)N(CC3=CC=C(C=C3)Cl)C4CCS(C4)(O)O

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)N(CC3=CC=C(C=C3)Cl)C4CCS(C4)(O)O

InChI

InChI=1S/C21H22ClNO4S/c1-14-18-4-2-3-5-19(18)27-20(14)21(24)23(17-10-11-28(25,26)13-17)12-15-6-8-16(22)9-7-15/h2-9,17,25-26H,10-13H2,1H3