N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-6-bromanyl-N-[(3-methoxyphenyl)methyl]-3-methyl-1-benzofuran-2-carboxamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-6-bromanyl-N-[(3-methoxyphenyl)methyl]-3-methyl-1-benzofuran-2-carboxamide Openeye Name: 6-bromo-N-[(3S)-1,1-dioxothiolan-3-yl]-N-[(3-methoxyphenyl)methyl]-3-methyl-benzofuran-2-carboxamide CAS Name: 6-bromo-N-[(3S)-1,1-dioxo-3-thiolanyl]-N-[(3-methoxyphenyl)methyl]-3-methyl-2-benzofurancarboxamide IUPAC Name: 6-bromo-N-[(3S)-1,1-dioxothiolan-3-yl]-N-[(3-methoxyphenyl)methyl]-3-methyl-1-benzofuran-2-carboxamide Traditional Name: 6-bromo-N-[(3S)-1,1-diketothiolan-3-yl]-N-m-anisyl-3-methyl-coumarilamide Formula: C22H22BrNO5S MolecularWeight: 492.38278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(OC2=C1C=CC(=C2)Br)C(=O)N(CC3=CC(=CC=C3)OC)[C@H]4CCS(=O)(=O)C4

InChI

InChI=1S/C22H22BrNO5S/c1-14-19-7-6-16(23)11-20(19)29-21(14)22(25)24(17-8-9-30(26,27)13-17)12-15-4-3-5-18(10-15)28-2/h3-7,10-11,17H,8-9,12-13H2,1-2H3/t17-/m0/s1