N-(butylcarbamoyl)-2-[1-(oxolan-2-ylmethyl)-5-phenyl-imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(butylcarbamoyl)-2-[1-(oxolan-2-ylmethyl)-5-phenyl-imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(butylcarbamoyl)-2-[5-phenyl-1-(tetrahydrofuran-2-ylmethyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-[butylamino(oxo)methyl]-2-[[1-(2-oxolanylmethyl)-5-phenyl-2-imidazolyl]thio]acetamide IUPAC Name: N-(butylcarbamoyl)-2-[1-(oxolan-2-ylmethyl)-5-phenylimidazol-2-yl]sulfanylacetamide Traditional Name: N-(butylcarbamoyl)-2-[[5-phenyl-1-(tetrahydrofurfuryl)imidazol-2-yl]thio]acetamide Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)CSC1=NC=C(N1CC2CCCO2)C3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)NC(=O)CSC1=NC=C(N1CC2CCCO2)C3=CC=CC=C3

InChI

InChI=1S/C21H28N4O3S/c1-2-3-11-22-20(27)24-19(26)15-29-21-23-13-18(16-8-5-4-6-9-16)25(21)14-17-10-7-12-28-17/h4-6,8-9,13,17H,2-3,7,10-12,14-15H2,1H3,(H2,22,24,26,27)