N-[1-[[1-(3-chlorophenyl)sulfonyl-3-oxidanylidene-azepan-4-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]-3-methyl-1-benzofuran-2-carboxamide

Systemtic Name: N-[1-[[1-(3-chlorophenyl)sulfonyl-3-oxidanylidene-azepan-4-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]-3-methyl-1-benzofuran-2-carboxamide Openeye Name: N-[1-[[1-(3-chlorophenyl)sulfonyl-3-oxo-azepan-4-yl]carbamoyl]-3-methyl-butyl]-3-methyl-benzofuran-2-carboxamide CAS Name: N-[1-[[1-(3-chlorophenyl)sulfonyl-3-oxo-4-azepanyl]amino]-4-methyl-1-oxopentan-2-yl]-3-methyl-2-benzofurancarboxamide IUPAC Name: N-[1-[[1-(3-chlorophenyl)sulfonyl-3-oxoazepan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]-3-methyl-1-benzofuran-2-carboxamide Traditional Name: N-[1-[[1-(3-chlorophenyl)sulfonyl-3-keto-azepan-4-yl]carbamoyl]-3-methyl-butyl]-3-methyl-coumarilamide Formula: C28H32ClN3O6S MolecularWeight: 574.08818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)NC(CC(C)C)C(=O)NC3CCCN(CC3=O)S(=O)(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)NC(CC(C)C)C(=O)NC3CCCN(CC3=O)S(=O)(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C28H32ClN3O6S/c1-17(2)14-23(31-28(35)26-18(3)21-10-4-5-12-25(21)38-26)27(34)30-22-11-7-13-32(16-24(22)33)39(36,37)20-9-6-8-19(29)15-20/h4-6,8-10,12,15,17,22-23H,7,11,13-14,16H2,1-3H3,(H,30,34)(H,31,35)