2-[(4-tert-butyl-1,3-thiazol-2-yl)sulfanyl]-N-[2-(4-prop-2-ynylpiperazin-1-yl)phenyl]ethanamide

Systemtic Name: 2-[(4-tert-butyl-1,3-thiazol-2-yl)sulfanyl]-N-[2-(4-prop-2-ynylpiperazin-1-yl)phenyl]ethanamide Openeye Name: 2-(4-tert-butylthiazol-2-yl)sulfanyl-N-[2-(4-prop-2-ynylpiperazin-1-yl)phenyl]acetamide CAS Name: 2-[(4-tert-butyl-2-thiazolyl)thio]-N-[2-(4-prop-2-ynyl-1-piperazinyl)phenyl]acetamide IUPAC Name: 2-[(4-tert-butyl-1,3-thiazol-2-yl)sulfanyl]-N-[2-(4-prop-2-ynylpiperazin-1-yl)phenyl]acetamide Traditional Name: 2-[(4-tert-butylthiazol-2-yl)thio]-N-[2-(4-propargylpiperazino)phenyl]acetamide Formula: C22H28N4OS2 MolecularWeight: 428.61392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)SCC(=O)NC2=CC=CC=C2N3CCN(CC3)CC#C

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)SCC(=O)NC2=CC=CC=C2N3CCN(CC3)CC#C

InChI

InChI=1S/C22H28N4OS2/c1-5-10-25-11-13-26(14-12-25)18-9-7-6-8-17(18)23-20(27)16-29-21-24-19(15-28-21)22(2,3)4/h1,6-9,15H,10-14,16H2,2-4H3,(H,23,27)