1-azanyl-3-(6-chloranylpyrimidin-4-yl)-5-nitro-2-propylsulfanyl-cyclopent-2-en-1-ol

Systemtic Name: 1-azanyl-3-(6-chloranylpyrimidin-4-yl)-5-nitro-2-propylsulfanyl-cyclopent-2-en-1-ol Openeye Name: 1-amino-3-(6-chloropyrimidin-4-yl)-5-nitro-2-propylsulfanyl-cyclopent-2-en-1-ol CAS Name: 1-amino-3-(6-chloro-4-pyrimidinyl)-5-nitro-2-(propylthio)-1-cyclopent-2-enol IUPAC Name: 1-amino-3-(6-chloropyrimidin-4-yl)-5-nitro-2-propylsulfanylcyclopent-2-en-1-ol Traditional Name: 1-amino-3-(6-chloropyrimidin-4-yl)-5-nitro-2-(propylthio)cyclopent-2-en-1-ol Formula: C12H15ClN4O3S MolecularWeight: 330.7905

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(CC(C1(N)O)[N+](=O)[O-])C2=CC(=NC=N2)Cl

Isomeric SMILES

CCCSC1=C(CC(C1(N)O)[N+](=O)[O-])C2=CC(=NC=N2)Cl

InChI

InChI=1S/C12H15ClN4O3S/c1-2-3-21-11-7(8-5-10(13)16-6-15-8)4-9(17(19)20)12(11,14)18/h5-6,9,18H,2-4,14H2,1H3