2-chloranyl-5-[[(2E)-2-(1-nitro-2-prop-2-ynylsulfanyl-ethylidene)imidazolidin-1-yl]methyl]pyridine

Systemtic Name: 2-chloranyl-5-[[(2E)-2-(1-nitro-2-prop-2-ynylsulfanyl-ethylidene)imidazolidin-1-yl]methyl]pyridine Openeye Name: 2-chloro-5-[[(2E)-2-(1-nitro-2-prop-2-ynylsulfanyl-ethylidene)imidazolidin-1-yl]methyl]pyridine CAS Name: 2-chloro-5-[[(2E)-2-[1-nitro-2-(prop-2-ynylthio)ethylidene]-1-imidazolidinyl]methyl]pyridine IUPAC Name: 2-chloro-5-[[(2E)-2-(1-nitro-2-prop-2-ynylsulfanylethylidene)imidazolidin-1-yl]methyl]pyridine Traditional Name: 2-chloro-5-[[(2E)-2-[1-nitro-2-(propargylthio)ethylidene]imidazolidin-1-yl]methyl]pyridine Formula: C14H15ClN4O2S MolecularWeight: 338.8125

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Descriptors Computed from Structure

Canonical SMILES:

C#CCSCC(=C1NCCN1CC2=CN=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C#CCSC/C(=C\1/NCCN1CC2=CN=C(C=C2)Cl)/[N+](=O)[O-]

InChI

InChI=1S/C14H15ClN4O2S/c1-2-7-22-10-12(19(20)21)14-16-5-6-18(14)9-11-3-4-13(15)17-8-11/h1,3-4,8,16H,5-7,9-10H2/b14-12+