3-[[2-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-oxidanylidene-ethyl]amino]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-[[2-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-oxidanylidene-ethyl]amino]-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[[2-[3,5-bis(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-oxo-ethyl]amino]-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[[2-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-oxoethyl]amino]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[[2-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-oxoethyl]amino]-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[[2-[3,5-bis(2-thienyl)-2-pyrazolin-1-yl]-2-keto-ethyl]amino]-N,N-dimethyl-benzenesulfonamide Formula: C21H22N4O3S3 MolecularWeight: 474.61938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)NCC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CS4

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)NCC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CS4

InChI

InChI=1S/C21H22N4O3S3/c1-24(2)31(27,28)16-7-3-6-15(12-16)22-14-21(26)25-18(20-9-5-11-30-20)13-17(23-25)19-8-4-10-29-19/h3-12,18,22H,13-14H2,1-2H3