3-(methylsulfanylmethyl)-N-(1-propylbenzimidazol-2-yl)-1-benzofuran-2-carboxamide

Systemtic Name: 3-(methylsulfanylmethyl)-N-(1-propylbenzimidazol-2-yl)-1-benzofuran-2-carboxamide Openeye Name: 3-(methylsulfanylmethyl)-N-(1-propylbenzimidazol-2-yl)benzofuran-2-carboxamide CAS Name: 3-[(methylthio)methyl]-N-(1-propyl-2-benzimidazolyl)-2-benzofurancarboxamide IUPAC Name: 3-(methylsulfanylmethyl)-N-(1-propylbenzimidazol-2-yl)-1-benzofuran-2-carboxamide Traditional Name: 3-[(methylthio)methyl]-N-(1-propylbenzimidazol-2-yl)coumarilamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N=C1NC(=O)C3=C(C4=CC=CC=C4O3)CSC

Isomeric SMILES

CCCN1C2=CC=CC=C2N=C1NC(=O)C3=C(C4=CC=CC=C4O3)CSC

InChI

InChI=1S/C21H21N3O2S/c1-3-12-24-17-10-6-5-9-16(17)22-21(24)23-20(25)19-15(13-27-2)14-8-4-7-11-18(14)26-19/h4-11H,3,12-13H2,1-2H3,(H,22,23,25)