N-(4-ethylphenyl)-5-[[ethyl-(phenylmethyl)amino]methyl]-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: N-(4-ethylphenyl)-5-[[ethyl-(phenylmethyl)amino]methyl]-1,3,4-thiadiazole-2-carboxamide Openeye Name: 5-[[benzyl(ethyl)amino]methyl]-N-(4-ethylphenyl)-1,3,4-thiadiazole-2-carboxamide CAS Name: N-(4-ethylphenyl)-5-[[ethyl-(phenylmethyl)amino]methyl]-1,3,4-thiadiazole-2-carboxamide IUPAC Name: 5-[[benzyl(ethyl)amino]methyl]-N-(4-ethylphenyl)-1,3,4-thiadiazole-2-carboxamide Traditional Name: 5-[[benzyl(ethyl)amino]methyl]-N-(4-ethylphenyl)-1,3,4-thiadiazole-2-carboxamide Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4OS/c1-3-16-10-12-18(13-11-16)22-20(26)21-24-23-19(27-21)15-25(4-2)14-17-8-6-5-7-9-17/h5-13H,3-4,14-15H2,1-2H3,(H,22,26)