N-(2-chlorophenyl)-4-pyrazin-2-yl-piperazine-1-carbothioamide

Systemtic Name: N-(2-chlorophenyl)-4-pyrazin-2-yl-piperazine-1-carbothioamide Openeye Name: N-(2-chlorophenyl)-4-pyrazin-2-yl-piperazine-1-carbothioamide CAS Name: N-(2-chlorophenyl)-4-(2-pyrazinyl)-1-piperazinecarbothioamide IUPAC Name: N-(2-chlorophenyl)-4-pyrazin-2-ylpiperazine-1-carbothioamide Traditional Name: N-(2-chlorophenyl)-4-pyrazin-2-yl-piperazine-1-carbothioamide Formula: C15H16ClN5S MolecularWeight: 333.83904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CN=C2)C(=S)NC3=CC=CC=C3Cl

Isomeric SMILES

C1CN(CCN1C2=NC=CN=C2)C(=S)NC3=CC=CC=C3Cl

InChI

InChI=1S/C15H16ClN5S/c16-12-3-1-2-4-13(12)19-15(22)21-9-7-20(8-10-21)14-11-17-5-6-18-14/h1-6,11H,7-10H2,(H,19,22)