(E)-3-[5-(4-bromophenyl)thiophen-2-yl]-1-(4-pyrazin-2-ylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-[5-(4-bromophenyl)thiophen-2-yl]-1-(4-pyrazin-2-ylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-[5-(4-bromophenyl)-2-thienyl]-1-(4-pyrazin-2-ylpiperazin-1-yl)prop-2-en-1-one CAS Name: (E)-3-[5-(4-bromophenyl)-2-thiophenyl]-1-[4-(2-pyrazinyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-[5-(4-bromophenyl)thiophen-2-yl]-1-(4-pyrazin-2-ylpiperazin-1-yl)prop-2-en-1-one Traditional Name: (E)-3-[5-(4-bromophenyl)-2-thienyl]-1-(4-pyrazin-2-ylpiperazino)prop-2-en-1-one Formula: C21H19BrN4OS MolecularWeight: 455.37076

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CN=C2)C(=O)C=CC3=CC=C(S3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CCN1C2=NC=CN=C2)C(=O)/C=C/C3=CC=C(S3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H19BrN4OS/c22-17-3-1-16(2-4-17)19-7-5-18(28-19)6-8-21(27)26-13-11-25(12-14-26)20-15-23-9-10-24-20/h1-10,15H,11-14H2/b8-6+