N-(furan-2-ylmethyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(furan-2-ylmethyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(2-furylmethyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-(2-furanylmethyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(furan-2-ylmethyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(2-furfuryl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]propionamide Formula: C16H16N4O2S MolecularWeight: 328.38884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CO1)SC2=NNC(=N2)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NCC1=CC=CO1)SC2=NNC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C16H16N4O2S/c1-11(15(21)17-10-13-8-5-9-22-13)23-16-18-14(19-20-16)12-6-3-2-4-7-12/h2-9,11H,10H2,1H3,(H,17,21)(H,18,19,20)