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

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-6-bromanyl-3-methyl-N-[(3-methylthiophen-2-yl)methyl]-1-benzofuran-2-carboxamide Openeye Name: 6-bromo-N-[(3S)-1,1-dioxothiolan-3-yl]-3-methyl-N-[(3-methyl-2-thienyl)methyl]benzofuran-2-carboxamide CAS Name: 6-bromo-N-[(3S)-1,1-dioxo-3-thiolanyl]-3-methyl-N-[(3-methyl-2-thiophenyl)methyl]-2-benzofurancarboxamide IUPAC Name: 6-bromo-N-[(3S)-1,1-dioxothiolan-3-yl]-3-methyl-N-[(3-methylthiophen-2-yl)methyl]-1-benzofuran-2-carboxamide Traditional Name: 6-bromo-N-[(3S)-1,1-diketothiolan-3-yl]-3-methyl-N-[(3-methyl-2-thienyl)methyl]coumarilamide Formula: C20H20BrNO4S2 MolecularWeight: 482.4111

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(C2CCS(=O)(=O)C2)C(=O)C3=C(C4=C(O3)C=C(C=C4)Br)C

Isomeric SMILES

CC1=C(SC=C1)CN([C@H]2CCS(=O)(=O)C2)C(=O)C3=C(C4=C(O3)C=C(C=C4)Br)C

InChI

InChI=1S/C20H20BrNO4S2/c1-12-5-7-27-18(12)10-22(15-6-8-28(24,25)11-15)20(23)19-13(2)16-4-3-14(21)9-17(16)26-19/h3-5,7,9,15H,6,8,10-11H2,1-2H3/t15-/m0/s1