N-(5-pentyl-1,3,4-thiadiazol-2-yl)-3-(phenylsulfonylmethyl)benzamide

Systemtic Name: N-(5-pentyl-1,3,4-thiadiazol-2-yl)-3-(phenylsulfonylmethyl)benzamide Openeye Name: 3-(benzenesulfonylmethyl)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 3-(benzenesulfonylmethyl)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 3-(benzenesulfonylmethyl)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: N-(5-amyl-1,3,4-thiadiazol-2-yl)-3-(besylmethyl)benzamide Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)NC(=O)C2=CC(=CC=C2)CS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCCC1=NN=C(S1)NC(=O)C2=CC(=CC=C2)CS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3O3S2/c1-2-3-5-13-19-23-24-21(28-19)22-20(25)17-10-8-9-16(14-17)15-29(26,27)18-11-6-4-7-12-18/h4,6-12,14H,2-3,5,13,15H2,1H3,(H,22,24,25)