N-(5-acetamido-2-methoxy-phenyl)-3-[3-(4-fluorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide

Systemtic Name: N-(5-acetamido-2-methoxy-phenyl)-3-[3-(4-fluorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Openeye Name: N-(5-acetamido-2-methoxy-phenyl)-3-[3-(4-fluorophenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-(5-acetamido-2-methoxyphenyl)-3-[3-(4-fluorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide IUPAC Name: N-(5-acetamido-2-methoxyphenyl)-3-[3-(4-fluorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Traditional Name: N-(5-acetamido-2-methoxy-phenyl)-3-[3-(4-fluorophenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C20H20FN5O3S MolecularWeight: 429.467903

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)CCN2C(=NNC2=S)C3=CC=C(C=C3)F

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)CCN2C(=NNC2=S)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H20FN5O3S/c1-12(27)22-15-7-8-17(29-2)16(11-15)23-18(28)9-10-26-19(24-25-20(26)30)13-3-5-14(21)6-4-13/h3-8,11H,9-10H2,1-2H3,(H,22,27)(H,23,28)(H,25,30)