N-(1-adamantylmethyl)-3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxamide Openeye Name: N-(1-adamantylmethyl)-3-(cyclohexylsulfanylmethyl)benzofuran-2-carboxamide CAS Name: N-(1-adamantylmethyl)-3-[(cyclohexylthio)methyl]-2-benzofurancarboxamide IUPAC Name: N-(1-adamantylmethyl)-3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxamide Traditional Name: N-(1-adamantylmethyl)-3-[(cyclohexylthio)methyl]coumarilamide Formula: C27H35NO2S MolecularWeight: 437.6373

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SCC2=C(OC3=CC=CC=C32)C(=O)NCC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CCC(CC1)SCC2=C(OC3=CC=CC=C32)C(=O)NCC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H35NO2S/c29-26(28-17-27-13-18-10-19(14-27)12-20(11-18)15-27)25-23(16-31-21-6-2-1-3-7-21)22-8-4-5-9-24(22)30-25/h4-5,8-9,18-21H,1-3,6-7,10-17H2,(H,28,29)