4-(1H-benzimidazol-2-ylsulfanyl)-N-[2-(pyridin-2-ylmethyl)pyrazol-3-yl]butanamide

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-[2-(pyridin-2-ylmethyl)pyrazol-3-yl]butanamide Openeye Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-[2-(2-pyridylmethyl)pyrazol-3-yl]butanamide CAS Name: 4-(1H-benzimidazol-2-ylthio)-N-[2-(2-pyridinylmethyl)-3-pyrazolyl]butanamide IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-[2-(pyridin-2-ylmethyl)pyrazol-3-yl]butanamide Traditional Name: 4-(1H-benzimidazol-2-ylthio)-N-[2-(2-pyridylmethyl)pyrazol-3-yl]butyramide Formula: C20H20N6OS MolecularWeight: 392.4774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCCCC(=O)NC3=CC=NN3CC4=CC=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCCCC(=O)NC3=CC=NN3CC4=CC=CC=N4

InChI

InChI=1S/C20H20N6OS/c27-19(9-5-13-28-20-23-16-7-1-2-8-17(16)24-20)25-18-10-12-22-26(18)14-15-6-3-4-11-21-15/h1-4,6-8,10-12H,5,9,13-14H2,(H,23,24)(H,25,27)