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

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)benzamide Formula: C18H23ClN4O3S2 MolecularWeight: 442.98322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC(C)C1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C18H23ClN4O3S2/c1-12(2)17-21-22-18(27-17)20-16(24)13-7-8-14(19)15(11-13)28(25,26)23-9-5-3-4-6-10-23/h7-8,11-12H,3-6,9-10H2,1-2H3,(H,20,22,24)