1-cyclohexyl-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,3,4-tetrazole

Systemtic Name: 1-cyclohexyl-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,3,4-tetrazole Openeye Name: 1-cyclohexyl-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]tetrazole CAS Name: 1-cyclohexyl-5-[[4-(1-pyrazolyl)phenyl]methylthio]tetrazole IUPAC Name: 1-cyclohexyl-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]tetrazole Traditional Name: 1-cyclohexyl-5-[(4-pyrazol-1-ylbenzyl)thio]tetrazole Formula: C17H20N6S MolecularWeight: 340.4459

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=N2)SCC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C1CCC(CC1)N2C(=NN=N2)SCC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C17H20N6S/c1-2-5-16(6-3-1)23-17(19-20-21-23)24-13-14-7-9-15(10-8-14)22-12-4-11-18-22/h4,7-12,16H,1-3,5-6,13H2