3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(5-isobutyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(5-isobutyl-1,3,4-thiadiazol-2-yl)benzamide Formula: C19H25ClN4O3S2 MolecularWeight: 457.0098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC(C)CC1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C19H25ClN4O3S2/c1-13(2)11-17-22-23-19(28-17)21-18(25)14-7-8-15(20)16(12-14)29(26,27)24-9-5-3-4-6-10-24/h7-8,12-13H,3-6,9-11H2,1-2H3,(H,21,23,25)