N-(furan-2-ylmethyl)-4-pyrimidin-2-yl-piperazine-1-carbothioamide

Systemtic Name: N-(furan-2-ylmethyl)-4-pyrimidin-2-yl-piperazine-1-carbothioamide Openeye Name: N-(2-furylmethyl)-4-pyrimidin-2-yl-piperazine-1-carbothioamide CAS Name: N-(2-furanylmethyl)-4-(2-pyrimidinyl)-1-piperazinecarbothioamide IUPAC Name: N-(furan-2-ylmethyl)-4-pyrimidin-2-ylpiperazine-1-carbothioamide Traditional Name: N-(2-furfuryl)-4-(2-pyrimidyl)piperazine-1-carbothioamide Formula: C14H17N5OS MolecularWeight: 303.38268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=S)NCC3=CC=CO3

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=S)NCC3=CC=CO3

InChI

InChI=1S/C14H17N5OS/c21-14(17-11-12-3-1-10-20-12)19-8-6-18(7-9-19)13-15-4-2-5-16-13/h1-5,10H,6-9,11H2,(H,17,21)