2-[(2-methylphenyl)-methylsulfonyl-amino]-N-(5-octyl-1,3,4-thiadiazol-2-yl)ethanamide

Systemtic Name: 2-[(2-methylphenyl)-methylsulfonyl-amino]-N-(5-octyl-1,3,4-thiadiazol-2-yl)ethanamide Openeye Name: 2-(2-methyl-N-methylsulfonyl-anilino)-N-(5-octyl-1,3,4-thiadiazol-2-yl)acetamide CAS Name: 2-(2-methyl-N-methylsulfonylanilino)-N-(5-octyl-1,3,4-thiadiazol-2-yl)acetamide IUPAC Name: 2-(2-methyl-N-methylsulfonylanilino)-N-(5-octyl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: 2-(N-mesyl-2-methyl-anilino)-N-(5-octyl-1,3,4-thiadiazol-2-yl)acetamide Formula: C20H30N4O3S2 MolecularWeight: 438.6072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=NN=C(S1)NC(=O)CN(C2=CC=CC=C2C)S(=O)(=O)C

Isomeric SMILES

CCCCCCCCC1=NN=C(S1)NC(=O)CN(C2=CC=CC=C2C)S(=O)(=O)C

InChI

InChI=1S/C20H30N4O3S2/c1-4-5-6-7-8-9-14-19-22-23-20(28-19)21-18(25)15-24(29(3,26)27)17-13-11-10-12-16(17)2/h10-13H,4-9,14-15H2,1-3H3,(H,21,23,25)