4-[4-(4-fluorophenyl)piperazin-1-yl]-5-nitro-6-phenylsulfanyl-pyrimidine

Systemtic Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-5-nitro-6-phenylsulfanyl-pyrimidine Openeye Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-5-nitro-6-phenylsulfanyl-pyrimidine CAS Name: 4-[4-(4-fluorophenyl)-1-piperazinyl]-5-nitro-6-(phenylthio)pyrimidine IUPAC Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-5-nitro-6-phenylsulfanylpyrimidine Traditional Name: 4-[4-(4-fluorophenyl)piperazino]-5-nitro-6-(phenylthio)pyrimidine Formula: C20H18FN5O2S MolecularWeight: 411.452623

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C3=C(C(=NC=N3)SC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C3=C(C(=NC=N3)SC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H18FN5O2S/c21-15-6-8-16(9-7-15)24-10-12-25(13-11-24)19-18(26(27)28)20(23-14-22-19)29-17-4-2-1-3-5-17/h1-9,14H,10-13H2