1-cyclopropyl-5-[[4-(4-methylphenyl)sulfonylphenyl]methylsulfanyl]-1,2,3,4-tetrazole

Systemtic Name: 1-cyclopropyl-5-[[4-(4-methylphenyl)sulfonylphenyl]methylsulfanyl]-1,2,3,4-tetrazole Openeye Name: 1-cyclopropyl-5-[[4-(p-tolylsulfonyl)phenyl]methylsulfanyl]tetrazole CAS Name: 1-cyclopropyl-5-[[4-(4-methylphenyl)sulfonylphenyl]methylthio]tetrazole IUPAC Name: 1-cyclopropyl-5-[[4-(4-methylphenyl)sulfonylphenyl]methylsulfanyl]tetrazole Traditional Name: 1-cyclopropyl-5-[(4-tosylbenzyl)thio]tetrazole Formula: C18H18N4O2S2 MolecularWeight: 386.49112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)CSC3=NN=NN3C4CC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)CSC3=NN=NN3C4CC4

InChI

InChI=1S/C18H18N4O2S2/c1-13-2-8-16(9-3-13)26(23,24)17-10-4-14(5-11-17)12-25-18-19-20-21-22(18)15-6-7-15/h2-5,8-11,15H,6-7,12H2,1H3