N-(4-ethylphenyl)-5-[[(3-fluoranyl-4-methoxy-phenyl)methyl-methyl-amino]methyl]-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: N-(4-ethylphenyl)-5-[[(3-fluoranyl-4-methoxy-phenyl)methyl-methyl-amino]methyl]-1,3,4-thiadiazole-2-carboxamide Openeye Name: N-(4-ethylphenyl)-5-[[(3-fluoro-4-methoxy-phenyl)methyl-methyl-amino]methyl]-1,3,4-thiadiazole-2-carboxamide CAS Name: N-(4-ethylphenyl)-5-[[(3-fluoro-4-methoxyphenyl)methyl-methylamino]methyl]-1,3,4-thiadiazole-2-carboxamide IUPAC Name: N-(4-ethylphenyl)-5-[[(3-fluoro-4-methoxyphenyl)methyl-methylamino]methyl]-1,3,4-thiadiazole-2-carboxamide Traditional Name: N-(4-ethylphenyl)-5-[[(3-fluoro-4-methoxy-benzyl)-methyl-amino]methyl]-1,3,4-thiadiazole-2-carboxamide Formula: C21H23FN4O2S MolecularWeight: 414.496323

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)CN(C)CC3=CC(=C(C=C3)OC)F

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)CN(C)CC3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C21H23FN4O2S/c1-4-14-5-8-16(9-6-14)23-20(27)21-25-24-19(29-21)13-26(2)12-15-7-10-18(28-3)17(22)11-15/h5-11H,4,12-13H2,1-3H3,(H,23,27)