N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-N-methyl-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-N-methyl-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-[(3-fluoro-4-methoxy-phenyl)methyl]-N-methyl-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide CAS Name: N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methyl-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methyl-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-(3-fluoro-4-methoxy-benzyl)-N-methyl-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide Formula: C16H21FN4O2S MolecularWeight: 352.426943

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)N(C)CC2=CC(=C(C=C2)OC)F

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)N(C)CC2=CC(=C(C=C2)OC)F

InChI

InChI=1S/C16H21FN4O2S/c1-4-5-14-18-19-16(24)21(14)10-15(22)20(2)9-11-6-7-13(23-3)12(17)8-11/h6-8H,4-5,9-10H2,1-3H3,(H,19,24)