2-chloranyl-N-(4-methyl-1,3-benzothiazol-2-yl)-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-(4-methyl-1,3-benzothiazol-2-yl)-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-(4-methyl-1,3-benzothiazol-2-yl)-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-chloro-N-(4-methyl-1,3-benzothiazol-2-yl)-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-(4-methyl-1,3-benzothiazol-2-yl)-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-(4-methyl-1,3-benzothiazol-2-yl)-5-piperidinosulfonyl-benzamide Formula: C20H20ClN3O3S2 MolecularWeight: 449.9741

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)Cl

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)Cl

InChI

InChI=1S/C20H20ClN3O3S2/c1-13-6-5-7-17-18(13)22-20(28-17)23-19(25)15-12-14(8-9-16(15)21)29(26,27)24-10-3-2-4-11-24/h5-9,12H,2-4,10-11H2,1H3,(H,22,23,25)