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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-(phenylmethyl)amino]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[benzyl-[3-(p-tolylmethyl)-1,2,4-thiadiazol-5-yl]amino]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-(phenylmethyl)amino]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[benzyl-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]acetamide Traditional Name: 2-[benzyl-[3-(4-methylbenzyl)-1,2,4-thiadiazol-5-yl]amino]-N-piperonyl-acetamide Formula: C27H26N4O3S MolecularWeight: 486.58534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=NSC(=N2)N(CC3=CC=CC=C3)CC(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=C(C=C1)CC2=NSC(=N2)N(CC3=CC=CC=C3)CC(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H26N4O3S/c1-19-7-9-20(10-8-19)14-25-29-27(35-30-25)31(16-21-5-3-2-4-6-21)17-26(32)28-15-22-11-12-23-24(13-22)34-18-33-23/h2-13H,14-18H2,1H3,(H,28,32)