4-(2-methylpropanoylamino)-N-[5-(phenylsulfonylmethyl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 4-(2-methylpropanoylamino)-N-[5-(phenylsulfonylmethyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: N-[5-(benzenesulfonylmethyl)-1,3,4-thiadiazol-2-yl]-4-(2-methylpropanoylamino)benzamide CAS Name: N-[5-(benzenesulfonylmethyl)-1,3,4-thiadiazol-2-yl]-4-[(2-methyl-1-oxopropyl)amino]benzamide IUPAC Name: N-[5-(benzenesulfonylmethyl)-1,3,4-thiadiazol-2-yl]-4-(2-methylpropanoylamino)benzamide Traditional Name: N-[5-(besylmethyl)-1,3,4-thiadiazol-2-yl]-4-(isobutyrylamino)benzamide Formula: C20H20N4O4S2 MolecularWeight: 444.5272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)CS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)CS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H20N4O4S2/c1-13(2)18(25)21-15-10-8-14(9-11-15)19(26)22-20-24-23-17(29-20)12-30(27,28)16-6-4-3-5-7-16/h3-11,13H,12H2,1-2H3,(H,21,25)(H,22,24,26)