1-[2-tert-butyl-4-(1,3-thiazol-2-yl)piperazin-1-yl]-3-phenyl-prop-2-yn-1-one

Systemtic Name: 1-[2-tert-butyl-4-(1,3-thiazol-2-yl)piperazin-1-yl]-3-phenyl-prop-2-yn-1-one Openeye Name: 1-(2-tert-butyl-4-thiazol-2-yl-piperazin-1-yl)-3-phenyl-prop-2-yn-1-one CAS Name: 1-[2-tert-butyl-4-(2-thiazolyl)-1-piperazinyl]-3-phenyl-2-propyn-1-one IUPAC Name: 1-[2-tert-butyl-4-(1,3-thiazol-2-yl)piperazin-1-yl]-3-phenylprop-2-yn-1-one Traditional Name: 1-(2-tert-butyl-4-thiazol-2-yl-piperazino)-3-phenyl-prop-2-yn-1-one Formula: C20H23N3OS MolecularWeight: 353.48112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CN(CCN1C(=O)C#CC2=CC=CC=C2)C3=NC=CS3

Isomeric SMILES

CC(C)(C)C1CN(CCN1C(=O)C#CC2=CC=CC=C2)C3=NC=CS3

InChI

InChI=1S/C20H23N3OS/c1-20(2,3)17-15-22(19-21-11-14-25-19)12-13-23(17)18(24)10-9-16-7-5-4-6-8-16/h4-8,11,14,17H,12-13,15H2,1-3H3