2-methyl-N-[4-[2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]phenyl]propanamide

Systemtic Name: 2-methyl-N-[4-[2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]phenyl]propanamide Openeye Name: 2-methyl-N-[4-[2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]phenyl]propanamide CAS Name: 2-methyl-N-[4-[1-oxo-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]ethyl]phenyl]propanamide IUPAC Name: 2-methyl-N-[4-[2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]propanamide Traditional Name: 2-methyl-N-[4-[2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]acetyl]phenyl]propionamide Formula: C18H18N4O2S2 MolecularWeight: 386.49112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)CSC2=NNC(=N2)C3=CC=CS3

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)CSC2=NNC(=N2)C3=CC=CS3

InChI

InChI=1S/C18H18N4O2S2/c1-11(2)17(24)19-13-7-5-12(6-8-13)14(23)10-26-18-20-16(21-22-18)15-4-3-9-25-15/h3-9,11H,10H2,1-2H3,(H,19,24)(H,20,21,22)