(E)-3-(4-tert-butylphenyl)-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(4-tert-butylphenyl)-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(4-tert-butylphenyl)-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(4-tert-butylphenyl)-1-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(4-tert-butylphenyl)-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(4-tert-butylphenyl)-1-[4-(2-thenoyl)piperazino]prop-2-en-1-one Formula: C22H26N2O2S MolecularWeight: 382.51904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C=CC(=O)N2CCN(CC2)C(=O)C3=CC=CS3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)/C=C/C(=O)N2CCN(CC2)C(=O)C3=CC=CS3

InChI

InChI=1S/C22H26N2O2S/c1-22(2,3)18-9-6-17(7-10-18)8-11-20(25)23-12-14-24(15-13-23)21(26)19-5-4-16-27-19/h4-11,16H,12-15H2,1-3H3/b11-8+