2-[[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-(phenylmethyl)amino]-N-phenethyl-ethanamide

Systemtic Name: 2-[[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-(phenylmethyl)amino]-N-phenethyl-ethanamide Openeye Name: 2-[benzyl-[3-(p-tolylmethyl)-1,2,4-thiadiazol-5-yl]amino]-N-phenethyl-acetamide CAS Name: 2-[[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-(phenylmethyl)amino]-N-phenethylacetamide IUPAC Name: 2-[benzyl-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-N-phenethylacetamide Traditional Name: 2-[benzyl-[3-(4-methylbenzyl)-1,2,4-thiadiazol-5-yl]amino]-N-phenethyl-acetamide Formula: C27H28N4OS MolecularWeight: 456.60242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=NSC(=N2)N(CC3=CC=CC=C3)CC(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CC2=NSC(=N2)N(CC3=CC=CC=C3)CC(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C27H28N4OS/c1-21-12-14-23(15-13-21)18-25-29-27(33-30-25)31(19-24-10-6-3-7-11-24)20-26(32)28-17-16-22-8-4-2-5-9-22/h2-15H,16-20H2,1H3,(H,28,32)