4-tert-butyl-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-yl-ethyl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-yl-ethyl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[2-(4-methylpiperazin-1-yl)-2-(3-thienyl)ethyl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[2-(4-methyl-1-piperazinyl)-2-(3-thiophenyl)ethyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-ylethyl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[2-(4-methylpiperazino)-2-(3-thienyl)ethyl]benzenesulfonamide Formula: C21H31N3O2S2 MolecularWeight: 421.61974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCC(C2=CSC=C2)N3CCN(CC3)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCC(C2=CSC=C2)N3CCN(CC3)C

InChI

InChI=1S/C21H31N3O2S2/c1-21(2,3)18-5-7-19(8-6-18)28(25,26)22-15-20(17-9-14-27-16-17)24-12-10-23(4)11-13-24/h5-9,14,16,20,22H,10-13,15H2,1-4H3