5-[(1S,2S)-2-chloranylcyclohexyl]sulfanyl-1-phenyl-1,2,3,4-tetrazole

Systemtic Name: 5-[(1S,2S)-2-chloranylcyclohexyl]sulfanyl-1-phenyl-1,2,3,4-tetrazole Openeye Name: 5-[(1S,2S)-2-chlorocyclohexyl]sulfanyl-1-phenyl-tetrazole CAS Name: 5-[[(1S,2S)-2-chlorocyclohexyl]thio]-1-phenyltetrazole IUPAC Name: 5-[(1S,2S)-2-chlorocyclohexyl]sulfanyl-1-phenyltetrazole Traditional Name: 5-[[(1S,2S)-2-chlorocyclohexyl]thio]-1-phenyl-tetrazole Formula: C13H15ClN4S MolecularWeight: 294.803

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)SC2=NN=NN2C3=CC=CC=C3)Cl

Isomeric SMILES

C1CC[C@@H]([C@H](C1)SC2=NN=NN2C3=CC=CC=C3)Cl

InChI

InChI=1S/C13H15ClN4S/c14-11-8-4-5-9-12(11)19-13-15-16-17-18(13)10-6-2-1-3-7-10/h1-3,6-7,11-12H,4-5,8-9H2/t11-,12-/m0/s1