N-[4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonylphenyl]-3-methyl-butanamide

Systemtic Name: N-[4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonylphenyl]-3-methyl-butanamide Openeye Name: N-[4-[[4-(1,3-benzothiazol-2-yl)-1-piperidyl]sulfonyl]phenyl]-3-methyl-butanamide CAS Name: N-[4-[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]sulfonyl]phenyl]-3-methylbutanamide IUPAC Name: N-[4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonylphenyl]-3-methylbutanamide Traditional Name: N-[4-[4-(1,3-benzothiazol-2-yl)piperidino]sulfonylphenyl]-3-methyl-butyramide Formula: C23H27N3O3S2 MolecularWeight: 457.60878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H27N3O3S2/c1-16(2)15-22(27)24-18-7-9-19(10-8-18)31(28,29)26-13-11-17(12-14-26)23-25-20-5-3-4-6-21(20)30-23/h3-10,16-17H,11-15H2,1-2H3,(H,24,27)