(E)-3-(5-methylthiophen-2-yl)-1-(4-pyrazin-2-ylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(5-methylthiophen-2-yl)-1-(4-pyrazin-2-ylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(5-methyl-2-thienyl)-1-(4-pyrazin-2-ylpiperazin-1-yl)prop-2-en-1-one CAS Name: (E)-3-(5-methyl-2-thiophenyl)-1-[4-(2-pyrazinyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(5-methylthiophen-2-yl)-1-(4-pyrazin-2-ylpiperazin-1-yl)prop-2-en-1-one Traditional Name: (E)-3-(5-methyl-2-thienyl)-1-(4-pyrazin-2-ylpiperazino)prop-2-en-1-one Formula: C16H18N4OS MolecularWeight: 314.40532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C=CC(=O)N2CCN(CC2)C3=NC=CN=C3

Isomeric SMILES

CC1=CC=C(S1)/C=C/C(=O)N2CCN(CC2)C3=NC=CN=C3

InChI

InChI=1S/C16H18N4OS/c1-13-2-3-14(22-13)4-5-16(21)20-10-8-19(9-11-20)15-12-17-6-7-18-15/h2-7,12H,8-11H2,1H3/b5-4+