3-(cyclohexylsulfanylmethyl)-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-1-benzofuran-2-carboxamide

Systemtic Name: 3-(cyclohexylsulfanylmethyl)-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-1-benzofuran-2-carboxamide Openeye Name: 3-(cyclohexylsulfanylmethyl)-N-[4-(4-methoxyphenyl)thiazol-2-yl]benzofuran-2-carboxamide CAS Name: 3-[(cyclohexylthio)methyl]-N-[4-(4-methoxyphenyl)-2-thiazolyl]-2-benzofurancarboxamide IUPAC Name: 3-(cyclohexylsulfanylmethyl)-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-1-benzofuran-2-carboxamide Traditional Name: 3-[(cyclohexylthio)methyl]-N-[4-(4-methoxyphenyl)thiazol-2-yl]coumarilamide Formula: C26H26N2O3S2 MolecularWeight: 478.62624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(C4=CC=CC=C4O3)CSC5CCCCC5

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(C4=CC=CC=C4O3)CSC5CCCCC5

InChI

InChI=1S/C26H26N2O3S2/c1-30-18-13-11-17(12-14-18)22-16-33-26(27-22)28-25(29)24-21(15-32-19-7-3-2-4-8-19)20-9-5-6-10-23(20)31-24/h5-6,9-14,16,19H,2-4,7-8,15H2,1H3,(H,27,28,29)