5-[(3-bromanyl-4-methoxy-phenyl)methylsulfanyl]-1-cyclopropyl-1,2,3,4-tetrazole

Systemtic Name: 5-[(3-bromanyl-4-methoxy-phenyl)methylsulfanyl]-1-cyclopropyl-1,2,3,4-tetrazole Openeye Name: 5-[(3-bromo-4-methoxy-phenyl)methylsulfanyl]-1-cyclopropyl-tetrazole CAS Name: 5-[(3-bromo-4-methoxyphenyl)methylthio]-1-cyclopropyltetrazole IUPAC Name: 5-[(3-bromo-4-methoxyphenyl)methylsulfanyl]-1-cyclopropyltetrazole Traditional Name: 5-[(3-bromo-4-methoxy-benzyl)thio]-1-cyclopropyl-tetrazole Formula: C12H13BrN4OS MolecularWeight: 341.22682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSC2=NN=NN2C3CC3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=NN=NN2C3CC3)Br

InChI

InChI=1S/C12H13BrN4OS/c1-18-11-5-2-8(6-10(11)13)7-19-12-14-15-16-17(12)9-3-4-9/h2,5-6,9H,3-4,7H2,1H3