N-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-bromanyl-N-[(3-chlorophenyl)methyl]-3-methyl-1-benzofuran-2-carboxamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-bromanyl-N-[(3-chlorophenyl)methyl]-3-methyl-1-benzofuran-2-carboxamide Openeye Name: 5-bromo-N-[(3-chlorophenyl)methyl]-N-(1,1-dioxothiolan-3-yl)-3-methyl-benzofuran-2-carboxamide CAS Name: 5-bromo-N-[(3-chlorophenyl)methyl]-N-(1,1-dioxo-3-thiolanyl)-3-methyl-2-benzofurancarboxamide IUPAC Name: 5-bromo-N-[(3-chlorophenyl)methyl]-N-(1,1-dioxothiolan-3-yl)-3-methyl-1-benzofuran-2-carboxamide Traditional Name: 5-bromo-N-(3-chlorobenzyl)-N-(1,1-diketothiolan-3-yl)-3-methyl-coumarilamide Formula: C21H19BrClNO4S MolecularWeight: 496.80186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)N(CC3=CC(=CC=C3)Cl)C4CCS(=O)(=O)C4

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)N(CC3=CC(=CC=C3)Cl)C4CCS(=O)(=O)C4

InChI

InChI=1S/C21H19BrClNO4S/c1-13-18-10-15(22)5-6-19(18)28-20(13)21(25)24(17-7-8-29(26,27)12-17)11-14-3-2-4-16(23)9-14/h2-6,9-10,17H,7-8,11-12H2,1H3