3-(4-methylpiperazin-1-yl)sulfonyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide

Systemtic Name: 3-(4-methylpiperazin-1-yl)sulfonyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide Openeye Name: 3-(4-methylpiperazin-1-yl)sulfonyl-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzamide CAS Name: 3-[(4-methyl-1-piperazinyl)sulfonyl]-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide IUPAC Name: 3-(4-methylpiperazin-1-yl)sulfonyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide Traditional Name: 3-(4-methylpiperazino)sulfonyl-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzamide Formula: C24H23N3O3S2 MolecularWeight: 465.58772

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C#CC4=CC=CS4

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C#CC4=CC=CS4

InChI

InChI=1S/C24H23N3O3S2/c1-26-12-14-27(15-13-26)32(29,30)23-9-3-6-20(18-23)24(28)25-21-7-2-5-19(17-21)10-11-22-8-4-16-31-22/h2-9,16-18H,12-15H2,1H3,(H,25,28)