2-[5-[4-(3-nitrophenyl)piperazin-1-yl]pentylsulfanyl]pyrimidin-5-ol

Systemtic Name: 2-[5-[4-(3-nitrophenyl)piperazin-1-yl]pentylsulfanyl]pyrimidin-5-ol Openeye Name: 2-[5-[4-(3-nitrophenyl)piperazin-1-yl]pentylsulfanyl]pyrimidin-5-ol CAS Name: 2-[5-[4-(3-nitrophenyl)-1-piperazinyl]pentylthio]-5-pyrimidinol IUPAC Name: 2-[5-[4-(3-nitrophenyl)piperazin-1-yl]pentylsulfanyl]pyrimidin-5-ol Traditional Name: 2-[5-[4-(3-nitrophenyl)piperazino]pentylthio]pyrimidin-5-ol Formula: C19H25N5O3S MolecularWeight: 403.4985

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCCSC2=NC=C(C=N2)O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CCCCCSC2=NC=C(C=N2)O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H25N5O3S/c25-18-14-20-19(21-15-18)28-12-3-1-2-7-22-8-10-23(11-9-22)16-5-4-6-17(13-16)24(26)27/h4-6,13-15,25H,1-3,7-12H2