N-(3-ethanoylphenyl)-2-[[4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-(3-ethanoylphenyl)-2-[[4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(3-acetylphenyl)-2-[[4-(2-furylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-(3-acetylphenyl)-2-[[4-(2-furanylmethyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(3-acetylphenyl)-2-[[4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-(3-acetylphenyl)-2-[[4-(2-furfuryl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C(=O)C)SC2=NN=CN2CC3=CC=CO3

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)C(=O)C)SC2=NN=CN2CC3=CC=CO3

InChI

InChI=1S/C18H18N4O3S/c1-12(23)14-5-3-6-15(9-14)20-17(24)13(2)26-18-21-19-11-22(18)10-16-7-4-8-25-16/h3-9,11,13H,10H2,1-2H3,(H,20,24)