N-[1-[[(4S,6R)-1-(cyclohexylmethyl)-6-methyl-3-oxidanylidene-azepan-4-yl]carbamoyl]cyclohexyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[1-[[(4S,6R)-1-(cyclohexylmethyl)-6-methyl-3-oxidanylidene-azepan-4-yl]carbamoyl]cyclohexyl]-1-benzofuran-2-carboxamide Openeye Name: N-[1-[[(4S,6R)-1-(cyclohexylmethyl)-6-methyl-3-oxo-azepan-4-yl]carbamoyl]cyclohexyl]benzofuran-2-carboxamide CAS Name: N-[1-[[[(4S,6R)-1-(cyclohexylmethyl)-6-methyl-3-oxo-4-azepanyl]amino]-oxomethyl]cyclohexyl]-2-benzofurancarboxamide IUPAC Name: N-[1-[[(4S,6R)-1-(cyclohexylmethyl)-6-methyl-3-oxoazepan-4-yl]carbamoyl]cyclohexyl]-1-benzofuran-2-carboxamide Traditional Name: N-[1-[[(4S,6R)-1-(cyclohexylmethyl)-3-keto-6-methyl-azepan-4-yl]carbamoyl]cyclohexyl]coumarilamide Formula: C30H41N3O4 MolecularWeight: 507.66424

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(=O)CN(C1)CC2CCCCC2)NC(=O)C3(CCCCC3)NC(=O)C4=CC5=CC=CC=C5O4

Isomeric SMILES

C[C@@H]1C[C@@H](C(=O)CN(C1)CC2CCCCC2)NC(=O)C3(CCCCC3)NC(=O)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C30H41N3O4/c1-21-16-24(25(34)20-33(18-21)19-22-10-4-2-5-11-22)31-29(36)30(14-8-3-9-15-30)32-28(35)27-17-23-12-6-7-13-26(23)37-27/h6-7,12-13,17,21-22,24H,2-5,8-11,14-16,18-20H2,1H3,(H,31,36)(H,32,35)/t21-,24+/m1/s1