N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]-1,3-benzothiazole-6-carboxamide CAS Name: N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: N-(4-methyl-3-piperidinosulfonyl-phenyl)-1,3-benzothiazole-6-carboxamide Formula: C20H21N3O3S2 MolecularWeight: 415.52904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)N=CS3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)N=CS3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C20H21N3O3S2/c1-14-5-7-16(12-19(14)28(25,26)23-9-3-2-4-10-23)22-20(24)15-6-8-17-18(11-15)27-13-21-17/h5-8,11-13H,2-4,9-10H2,1H3,(H,22,24)