1-[3-(5-chloranylpyrimidin-2-yl)sulfanylpropyl]azocane

Systemtic Name: 1-[3-(5-chloranylpyrimidin-2-yl)sulfanylpropyl]azocane Openeye Name: 1-[3-(5-chloropyrimidin-2-yl)sulfanylpropyl]azocane CAS Name: 1-[3-[(5-chloro-2-pyrimidinyl)thio]propyl]azocane IUPAC Name: 1-[3-(5-chloropyrimidin-2-yl)sulfanylpropyl]azocane Traditional Name: 1-[3-[(5-chloropyrimidin-2-yl)thio]propyl]azocane Formula: C14H22ClN3S MolecularWeight: 299.86258

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)CCCSC2=NC=C(C=N2)Cl

Isomeric SMILES

C1CCCN(CCC1)CCCSC2=NC=C(C=N2)Cl

InChI

InChI=1S/C14H22ClN3S/c15-13-11-16-14(17-12-13)19-10-6-9-18-7-4-2-1-3-5-8-18/h11-12H,1-10H2