4-(1H-benzimidazol-2-ylsulfanyl)-N-(furan-2-ylmethyl)butanamide

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-(furan-2-ylmethyl)butanamide Openeye Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-(2-furylmethyl)butanamide CAS Name: 4-(1H-benzimidazol-2-ylthio)-N-(2-furanylmethyl)butanamide IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-(furan-2-ylmethyl)butanamide Traditional Name: 4-(1H-benzimidazol-2-ylthio)-N-(2-furfuryl)butyramide Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCCCC(=O)NCC3=CC=CO3

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCCCC(=O)NCC3=CC=CO3

InChI

InChI=1S/C16H17N3O2S/c20-15(17-11-12-5-3-9-21-12)8-4-10-22-16-18-13-6-1-2-7-14(13)19-16/h1-3,5-7,9H,4,8,10-11H2,(H,17,20)(H,18,19)