N-[1-[[1-(2-fluorophenyl)sulfonyl-3-oxidanylidene-azepan-4-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]-5-methyl-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-methyl-1-benzofuran-2-carboxamide Openeye Name: N-[1-[[1-(2-fluorophenyl)sulfonyl-3-oxo-azepan-4-yl]carbamoyl]-3-methyl-butyl]-5-methyl-benzofuran-2-carboxamide CAS Name: N-[1-[[1-(2-fluorophenyl)sulfonyl-3-oxo-4-azepanyl]amino]-4-methyl-1-oxopentan-2-yl]-5-methyl-2-benzofurancarboxamide IUPAC Name: N-[1-[[1-(2-fluorophenyl)sulfonyl-3-oxoazepan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]-5-methyl-1-benzofuran-2-carboxamide Traditional Name: N-[1-[[1-(2-fluorophenyl)sulfonyl-3-keto-azepan-4-yl]carbamoyl]-3-methyl-butyl]-5-methyl-coumarilamide Formula: C28H32FN3O6S MolecularWeight: 557.633583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=C2)C(=O)NC(CC(C)C)C(=O)NC3CCCN(CC3=O)S(=O)(=O)C4=CC=CC=C4F

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=C2)C(=O)NC(CC(C)C)C(=O)NC3CCCN(CC3=O)S(=O)(=O)C4=CC=CC=C4F

InChI

InChI=1S/C28H32FN3O6S/c1-17(2)13-22(31-28(35)25-15-19-14-18(3)10-11-24(19)38-25)27(34)30-21-8-6-12-32(16-23(21)33)39(36,37)26-9-5-4-7-20(26)29/h4-5,7,9-11,14-15,17,21-22H,6,8,12-13,16H2,1-3H3,(H,30,34)(H,31,35)