3-(cyclohexylsulfanylmethyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-1-benzofuran-2-carboxamide

Systemtic Name: 3-(cyclohexylsulfanylmethyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-1-benzofuran-2-carboxamide Openeye Name: 3-(cyclohexylsulfanylmethyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzofuran-2-carboxamide CAS Name: 3-[(cyclohexylthio)methyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-benzofurancarboxamide IUPAC Name: 3-(cyclohexylsulfanylmethyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-1-benzofuran-2-carboxamide Traditional Name: 3-[(cyclohexylthio)methyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)coumarilamide Formula: C25H26N2O3S2 MolecularWeight: 466.61554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C4=CC=CC=C4O3)CSC5CCCCC5

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C4=CC=CC=C4O3)CSC5CCCCC5

InChI

InChI=1S/C25H26N2O3S2/c1-2-29-16-12-13-20-22(14-16)32-25(26-20)27-24(28)23-19(15-31-17-8-4-3-5-9-17)18-10-6-7-11-21(18)30-23/h6-7,10-14,17H,2-5,8-9,15H2,1H3,(H,26,27,28)