3-[1-[(2,5-dimethylphenyl)methyl]-5-oxidanylidene-4-thiophen-2-yl-1,2,4-triazol-3-yl]-N,N-dimethyl-piperidine-1-sulfonamide

Systemtic Name: 3-[1-[(2,5-dimethylphenyl)methyl]-5-oxidanylidene-4-thiophen-2-yl-1,2,4-triazol-3-yl]-N,N-dimethyl-piperidine-1-sulfonamide Openeye Name: 3-[1-[(2,5-dimethylphenyl)methyl]-5-oxo-4-(2-thienyl)-1,2,4-triazol-3-yl]-N,N-dimethyl-piperidine-1-sulfonamide CAS Name: 3-[1-[(2,5-dimethylphenyl)methyl]-5-oxo-4-thiophen-2-yl-1,2,4-triazol-3-yl]-N,N-dimethyl-1-piperidinesulfonamide IUPAC Name: 3-[1-[(2,5-dimethylphenyl)methyl]-5-oxo-4-thiophen-2-yl-1,2,4-triazol-3-yl]-N,N-dimethylpiperidine-1-sulfonamide Traditional Name: 3-[1-(2,5-dimethylbenzyl)-5-keto-4-(2-thienyl)-1,2,4-triazol-3-yl]-N,N-dimethyl-piperidine-1-sulfonamide Formula: C22H29N5O3S2 MolecularWeight: 475.62736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2C(=O)N(C(=N2)C3CCCN(C3)S(=O)(=O)N(C)C)C4=CC=CS4

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2C(=O)N(C(=N2)C3CCCN(C3)S(=O)(=O)N(C)C)C4=CC=CS4

InChI

InChI=1S/C22H29N5O3S2/c1-16-9-10-17(2)19(13-16)15-26-22(28)27(20-8-6-12-31-20)21(23-26)18-7-5-11-25(14-18)32(29,30)24(3)4/h6,8-10,12-13,18H,5,7,11,14-15H2,1-4H3