3-[4-(4-fluorophenyl)piperazin-1-yl]pyrazine-2-carbothioamide

Systemtic Name: 3-[4-(4-fluorophenyl)piperazin-1-yl]pyrazine-2-carbothioamide Openeye Name: 3-[4-(4-fluorophenyl)piperazin-1-yl]pyrazine-2-carbothioamide CAS Name: 3-[4-(4-fluorophenyl)-1-piperazinyl]-2-pyrazinecarbothioamide IUPAC Name: 3-[4-(4-fluorophenyl)piperazin-1-yl]pyrazine-2-carbothioamide Traditional Name: 3-[4-(4-fluorophenyl)piperazino]thiopyrazinamide Formula: C15H16FN5S MolecularWeight: 317.384443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C3=NC=CN=C3C(=S)N

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C3=NC=CN=C3C(=S)N

InChI

InChI=1S/C15H16FN5S/c16-11-1-3-12(4-2-11)20-7-9-21(10-8-20)15-13(14(17)22)18-5-6-19-15/h1-6H,7-10H2,(H2,17,22)