3-(cyclohexylsulfanylmethyl)-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-1-benzofuran-2-carboxamide

Systemtic Name: 3-(cyclohexylsulfanylmethyl)-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-1-benzofuran-2-carboxamide Openeye Name: 3-(cyclohexylsulfanylmethyl)-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]benzofuran-2-carboxamide CAS Name: 3-[(cyclohexylthio)methyl]-N-[(4-methoxyphenyl)-(1-methyl-2-imidazolyl)methyl]-2-benzofurancarboxamide IUPAC Name: 3-(cyclohexylsulfanylmethyl)-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-1-benzofuran-2-carboxamide Traditional Name: 3-[(cyclohexylthio)methyl]-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]coumarilamide Formula: C28H31N3O3S MolecularWeight: 489.62904

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=C(C=C2)OC)NC(=O)C3=C(C4=CC=CC=C4O3)CSC5CCCCC5

Isomeric SMILES

CN1C=CN=C1C(C2=CC=C(C=C2)OC)NC(=O)C3=C(C4=CC=CC=C4O3)CSC5CCCCC5

InChI

InChI=1S/C28H31N3O3S/c1-31-17-16-29-27(31)25(19-12-14-20(33-2)15-13-19)30-28(32)26-23(18-35-21-8-4-3-5-9-21)22-10-6-7-11-24(22)34-26/h6-7,10-17,21,25H,3-5,8-9,18H2,1-2H3,(H,30,32)