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

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(2-chlorophenyl)methyl]-3-methyl-1-benzofuran-2-carboxamide Openeye Name: N-[(2-chlorophenyl)methyl]-N-[(3S)-1,1-dioxothiolan-3-yl]-3-methyl-benzofuran-2-carboxamide CAS Name: N-[(2-chlorophenyl)methyl]-N-[(3S)-1,1-dioxo-3-thiolanyl]-3-methyl-2-benzofurancarboxamide IUPAC Name: N-[(2-chlorophenyl)methyl]-N-[(3S)-1,1-dioxothiolan-3-yl]-3-methyl-1-benzofuran-2-carboxamide Traditional Name: N-(2-chlorobenzyl)-N-[(3S)-1,1-diketothiolan-3-yl]-3-methyl-coumarilamide Formula: C21H20ClNO4S MolecularWeight: 417.9058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)N(CC3=CC=CC=C3Cl)C4CCS(=O)(=O)C4

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)N(CC3=CC=CC=C3Cl)[C@H]4CCS(=O)(=O)C4

InChI

InChI=1S/C21H20ClNO4S/c1-14-17-7-3-5-9-19(17)27-20(14)21(24)23(16-10-11-28(25,26)13-16)12-15-6-2-4-8-18(15)22/h2-9,16H,10-13H2,1H3/t16-/m0/s1