N-(furan-2-ylmethyl)-3-methyl-2-[(3-methylphenyl)methylsulfanyl]benzimidazole-5-carboxamide

Systemtic Name: N-(furan-2-ylmethyl)-3-methyl-2-[(3-methylphenyl)methylsulfanyl]benzimidazole-5-carboxamide Openeye Name: N-(2-furylmethyl)-3-methyl-2-(m-tolylmethylsulfanyl)benzimidazole-5-carboxamide CAS Name: N-(2-furanylmethyl)-3-methyl-2-[(3-methylphenyl)methylthio]-5-benzimidazolecarboxamide IUPAC Name: N-(furan-2-ylmethyl)-3-methyl-2-[(3-methylphenyl)methylsulfanyl]benzimidazole-5-carboxamide Traditional Name: N-(2-furfuryl)-3-methyl-2-[(3-methylbenzyl)thio]benzimidazole-5-carboxamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NC3=C(N2C)C=C(C=C3)C(=O)NCC4=CC=CO4

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NC3=C(N2C)C=C(C=C3)C(=O)NCC4=CC=CO4

InChI

InChI=1S/C22H21N3O2S/c1-15-5-3-6-16(11-15)14-28-22-24-19-9-8-17(12-20(19)25(22)2)21(26)23-13-18-7-4-10-27-18/h3-12H,13-14H2,1-2H3,(H,23,26)