N-[1,1-bis(oxidanyl)thiolan-3-yl]-3,6-dimethyl-N-(phenylmethyl)-1-benzofuran-2-carboxamide

Systemtic Name: N-[1,1-bis(oxidanyl)thiolan-3-yl]-3,6-dimethyl-N-(phenylmethyl)-1-benzofuran-2-carboxamide Openeye Name: N-benzyl-N-(1,1-dihydroxythiolan-3-yl)-3,6-dimethyl-benzofuran-2-carboxamide CAS Name: N-(1,1-dihydroxy-3-thiolanyl)-3,6-dimethyl-N-(phenylmethyl)-2-benzofurancarboxamide IUPAC Name: N-benzyl-N-(1,1-dihydroxythiolan-3-yl)-3,6-dimethyl-1-benzofuran-2-carboxamide Traditional Name: N-benzyl-N-(1,1-dihydroxythiolan-3-yl)-3,6-dimethyl-coumarilamide Formula: C22H25NO4S MolecularWeight: 399.5032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(O2)C(=O)N(CC3=CC=CC=C3)C4CCS(C4)(O)O)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(O2)C(=O)N(CC3=CC=CC=C3)C4CCS(C4)(O)O)C

InChI

InChI=1S/C22H25NO4S/c1-15-8-9-19-16(2)21(27-20(19)12-15)22(24)23(13-17-6-4-3-5-7-17)18-10-11-28(25,26)14-18/h3-9,12,18,25-26H,10-11,13-14H2,1-2H3