3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(4-cyclopropylthiazol-2-yl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-(4-cyclopropyl-2-thiazolyl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(4-cyclopropylthiazol-2-yl)benzamide Formula: C19H22ClN3O3S2 MolecularWeight: 439.97928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=NC(=CS3)C4CC4)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=NC(=CS3)C4CC4)Cl

InChI

InChI=1S/C19H22ClN3O3S2/c20-15-8-7-14(18(24)22-19-21-16(12-27-19)13-5-6-13)11-17(15)28(25,26)23-9-3-1-2-4-10-23/h7-8,11-13H,1-6,9-10H2,(H,21,22,24)