3-methyl-N-[1-[(7-methyl-3-oxidanylidene-1-pyridin-2-ylsulfonyl-azepan-4-yl)carbamoyl]cyclohexyl]-1-benzofuran-2-carboxamide

Systemtic Name: 3-methyl-N-[1-[(7-methyl-3-oxidanylidene-1-pyridin-2-ylsulfonyl-azepan-4-yl)carbamoyl]cyclohexyl]-1-benzofuran-2-carboxamide Openeye Name: 3-methyl-N-[1-[[7-methyl-3-oxo-1-(2-pyridylsulfonyl)azepan-4-yl]carbamoyl]cyclohexyl]benzofuran-2-carboxamide CAS Name: 3-methyl-N-[1-[[[7-methyl-3-oxo-1-(2-pyridinylsulfonyl)-4-azepanyl]amino]-oxomethyl]cyclohexyl]-2-benzofurancarboxamide IUPAC Name: 3-methyl-N-[1-[(7-methyl-3-oxo-1-pyridin-2-ylsulfonylazepan-4-yl)carbamoyl]cyclohexyl]-1-benzofuran-2-carboxamide Traditional Name: N-[1-[[3-keto-7-methyl-1-(2-pyridylsulfonyl)azepan-4-yl]carbamoyl]cyclohexyl]-3-methyl-coumarilamide Formula: C29H34N4O6S MolecularWeight: 566.66846

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(=O)CN1S(=O)(=O)C2=CC=CC=N2)NC(=O)C3(CCCCC3)NC(=O)C4=C(C5=CC=CC=C5O4)C

Isomeric SMILES

CC1CCC(C(=O)CN1S(=O)(=O)C2=CC=CC=N2)NC(=O)C3(CCCCC3)NC(=O)C4=C(C5=CC=CC=C5O4)C

InChI

InChI=1S/C29H34N4O6S/c1-19-13-14-22(23(34)18-33(19)40(37,38)25-12-6-9-17-30-25)31-28(36)29(15-7-3-8-16-29)32-27(35)26-20(2)21-10-4-5-11-24(21)39-26/h4-6,9-12,17,19,22H,3,7-8,13-16,18H2,1-2H3,(H,31,36)(H,32,35)