4-[methyl-(4-methylphenyl)sulfonyl-amino]-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 4-[methyl-(4-methylphenyl)sulfonyl-amino]-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-4-[methyl(p-tolylsulfonyl)amino]benzamide CAS Name: 4-[methyl-(4-methylphenyl)sulfonylamino]-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 4-[methyl-(4-methylphenyl)sulfonylamino]-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-4-[methyl(tosyl)amino]benzamide Formula: C22H26N4O3S2 MolecularWeight: 458.59684

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=O)C2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)C2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H26N4O3S2/c1-5-16(6-2)21-24-25-22(30-21)23-20(27)17-9-11-18(12-10-17)26(4)31(28,29)19-13-7-15(3)8-14-19/h7-14,16H,5-6H2,1-4H3,(H,23,25,27)