N-(2-chlorophenyl)-3-[(3,5-dimethylpiperidin-1-yl)methyl]-2-sulfanylidene-1,3-benzoxazole-6-sulfonamide

Systemtic Name: N-(2-chlorophenyl)-3-[(3,5-dimethylpiperidin-1-yl)methyl]-2-sulfanylidene-1,3-benzoxazole-6-sulfonamide Openeye Name: N-(2-chlorophenyl)-3-[(3,5-dimethyl-1-piperidyl)methyl]-2-thioxo-1,3-benzoxazole-6-sulfonamide CAS Name: N-(2-chlorophenyl)-3-[(3,5-dimethyl-1-piperidinyl)methyl]-2-sulfanylidene-1,3-benzoxazole-6-sulfonamide IUPAC Name: N-(2-chlorophenyl)-3-[(3,5-dimethylpiperidin-1-yl)methyl]-2-sulfanylidene-1,3-benzoxazole-6-sulfonamide Traditional Name: N-(2-chlorophenyl)-3-[(3,5-dimethylpiperidino)methyl]-2-thioxo-1,3-benzoxazole-6-sulfonamide Formula: C21H24ClN3O3S2 MolecularWeight: 466.01656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)CN2C3=C(C=C(C=C3)S(=O)(=O)NC4=CC=CC=C4Cl)OC2=S)C

Isomeric SMILES

CC1CC(CN(C1)CN2C3=C(C=C(C=C3)S(=O)(=O)NC4=CC=CC=C4Cl)OC2=S)C

InChI

InChI=1S/C21H24ClN3O3S2/c1-14-9-15(2)12-24(11-14)13-25-19-8-7-16(10-20(19)28-21(25)29)30(26,27)23-18-6-4-3-5-17(18)22/h3-8,10,14-15,23H,9,11-13H2,1-2H3