3-[5-nitro-6-[4-(phenylmethyl)piperazin-1-yl]pyrimidin-4-yl]-1,3-thiazolidine

Systemtic Name: 3-[5-nitro-6-[4-(phenylmethyl)piperazin-1-yl]pyrimidin-4-yl]-1,3-thiazolidine Openeye Name: 3-[6-(4-benzylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]thiazolidine CAS Name: 3-[5-nitro-6-[4-(phenylmethyl)-1-piperazinyl]-4-pyrimidinyl]thiazolidine IUPAC Name: 3-[6-(4-benzylpiperazin-1-yl)-5-nitropyrimidin-4-yl]-1,3-thiazolidine Traditional Name: 3-[6-(4-benzylpiperazino)-5-nitro-pyrimidin-4-yl]thiazolidine Formula: C18H22N6O2S MolecularWeight: 386.47128

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=C(C(=NC=N3)N4CCSC4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=C(C(=NC=N3)N4CCSC4)[N+](=O)[O-]

InChI

InChI=1S/C18H22N6O2S/c25-24(26)16-17(19-13-20-18(16)23-10-11-27-14-23)22-8-6-21(7-9-22)12-15-4-2-1-3-5-15/h1-5,13H,6-12,14H2