[2,5-bis(chloranyl)thiophen-3-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [2,5-bis(chloranyl)thiophen-3-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (2,5-dichloro-3-thienyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (2,5-dichloro-3-thiophenyl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (2,5-dichlorothiophen-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (2,5-dichloro-3-thienyl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C13H12Cl2N4OS MolecularWeight: 343.23158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=C(SC(=C3)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=C(SC(=C3)Cl)Cl

InChI

InChI=1S/C13H12Cl2N4OS/c14-10-8-9(11(15)21-10)12(20)18-4-6-19(7-5-18)13-16-2-1-3-17-13/h1-3,8H,4-7H2