N-[1-[[1-(2-fluorophenyl)sulfonyl-3-oxidanylidene-azepan-4-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]-5,6-dimethoxy-1-benzofuran-2-carboxamide

Systemtic Name: N-[1-[[1-(2-fluorophenyl)sulfonyl-3-oxidanylidene-azepan-4-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]-5,6-dimethoxy-1-benzofuran-2-carboxamide Openeye Name: N-[1-[[1-(2-fluorophenyl)sulfonyl-3-oxo-azepan-4-yl]carbamoyl]-3-methyl-butyl]-5,6-dimethoxy-benzofuran-2-carboxamide CAS Name: N-[1-[[1-(2-fluorophenyl)sulfonyl-3-oxo-4-azepanyl]amino]-4-methyl-1-oxopentan-2-yl]-5,6-dimethoxy-2-benzofurancarboxamide IUPAC Name: N-[1-[[1-(2-fluorophenyl)sulfonyl-3-oxoazepan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]-5,6-dimethoxy-1-benzofuran-2-carboxamide Traditional Name: N-[1-[[1-(2-fluorophenyl)sulfonyl-3-keto-azepan-4-yl]carbamoyl]-3-methyl-butyl]-5,6-dimethoxy-coumarilamide Formula: C29H34FN3O8S MolecularWeight: 603.658963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1CCCN(CC1=O)S(=O)(=O)C2=CC=CC=C2F)NC(=O)C3=CC4=CC(=C(C=C4O3)OC)OC

Isomeric SMILES

CC(C)CC(C(=O)NC1CCCN(CC1=O)S(=O)(=O)C2=CC=CC=C2F)NC(=O)C3=CC4=CC(=C(C=C4O3)OC)OC

InChI

InChI=1S/C29H34FN3O8S/c1-17(2)12-21(32-29(36)26-14-18-13-24(39-3)25(40-4)15-23(18)41-26)28(35)31-20-9-7-11-33(16-22(20)34)42(37,38)27-10-6-5-8-19(27)30/h5-6,8,10,13-15,17,20-21H,7,9,11-12,16H2,1-4H3,(H,31,35)(H,32,36)