N-(2,5-dimethylpyrazol-3-yl)-2-[1-(furan-2-ylmethyl)-5-phenyl-imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2,5-dimethylpyrazol-3-yl)-2-[1-(furan-2-ylmethyl)-5-phenyl-imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(2,5-dimethylpyrazol-3-yl)-2-[1-(2-furylmethyl)-5-phenyl-imidazol-2-yl]sulfanyl-acetamide CAS Name: N-(2,5-dimethyl-3-pyrazolyl)-2-[[1-(2-furanylmethyl)-5-phenyl-2-imidazolyl]thio]acetamide IUPAC Name: N-(2,5-dimethylpyrazol-3-yl)-2-[1-(furan-2-ylmethyl)-5-phenylimidazol-2-yl]sulfanylacetamide Traditional Name: N-(2,5-dimethylpyrazol-3-yl)-2-[[1-(2-furfuryl)-5-phenyl-imidazol-2-yl]thio]acetamide Formula: C21H21N5O2S MolecularWeight: 407.48874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CSC2=NC=C(N2CC3=CC=CO3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CSC2=NC=C(N2CC3=CC=CO3)C4=CC=CC=C4)C

InChI

InChI=1S/C21H21N5O2S/c1-15-11-19(25(2)24-15)23-20(27)14-29-21-22-12-18(16-7-4-3-5-8-16)26(21)13-17-9-6-10-28-17/h3-12H,13-14H2,1-2H3,(H,23,27)