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

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: N-(5-amyl-1,3,4-thiadiazol-2-yl)-3-(azepan-1-ylsulfonyl)benzamide Formula: C20H28N4O3S2 MolecularWeight: 436.59132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCCCCC1=NN=C(S1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C20H28N4O3S2/c1-2-3-6-12-18-22-23-20(28-18)21-19(25)16-10-9-11-17(15-16)29(26,27)24-13-7-4-5-8-14-24/h9-11,15H,2-8,12-14H2,1H3,(H,21,23,25)