5-(4-fluorophenyl)-3-[[4-(6-nitropyridin-3-yl)piperazin-1-yl]methyl]-1,3-oxazole-2-thione

Systemtic Name: 5-(4-fluorophenyl)-3-[[4-(6-nitropyridin-3-yl)piperazin-1-yl]methyl]-1,3-oxazole-2-thione Openeye Name: 5-(4-fluorophenyl)-3-[[4-(6-nitro-3-pyridyl)piperazin-1-yl]methyl]oxazole-2-thione CAS Name: 5-(4-fluorophenyl)-3-[[4-(6-nitro-3-pyridinyl)-1-piperazinyl]methyl]-2-oxazolethione IUPAC Name: 5-(4-fluorophenyl)-3-[[4-(6-nitropyridin-3-yl)piperazin-1-yl]methyl]-1,3-oxazole-2-thione Traditional Name: 5-(4-fluorophenyl)-3-[[4-(6-nitro-3-pyridyl)piperazino]methyl]-4-oxazoline-2-thione Formula: C19H18FN5O3S MolecularWeight: 415.441323

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C=C(OC2=S)C3=CC=C(C=C3)F)C4=CN=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CN2C=C(OC2=S)C3=CC=C(C=C3)F)C4=CN=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H18FN5O3S/c20-15-3-1-14(2-4-15)17-12-24(19(29)28-17)13-22-7-9-23(10-8-22)16-5-6-18(21-11-16)25(26)27/h1-6,11-12H,7-10,13H2