N-phthalazin-5-yl-4-pyridin-2-yl-piperazine-1-carbothioamide

Systemtic Name: N-phthalazin-5-yl-4-pyridin-2-yl-piperazine-1-carbothioamide Openeye Name: N-phthalazin-5-yl-4-(2-pyridyl)piperazine-1-carbothioamide CAS Name: N-(5-phthalazinyl)-4-(2-pyridinyl)-1-piperazinecarbothioamide IUPAC Name: N-phthalazin-5-yl-4-pyridin-2-ylpiperazine-1-carbothioamide Traditional Name: N-phthalazin-5-yl-4-(2-pyridyl)piperazine-1-carbothioamide Formula: C18H18N6S MolecularWeight: 350.44072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=S)NC3=CC=CC4=CN=NC=C43

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=S)NC3=CC=CC4=CN=NC=C43

InChI

InChI=1S/C18H18N6S/c25-18(22-16-5-3-4-14-12-20-21-13-15(14)16)24-10-8-23(9-11-24)17-6-1-2-7-19-17/h1-7,12-13H,8-11H2,(H,22,25)