3-[(4-bromophenyl)methylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-amine

Systemtic Name: 3-[(4-bromophenyl)methylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-amine Openeye Name: 3-[(4-bromophenyl)methylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-amine CAS Name: 3-[(4-bromophenyl)methylthio]-5-cyclopropyl-1,2,4-triazol-4-amine IUPAC Name: 3-[(4-bromophenyl)methylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-amine Traditional Name: [3-[(4-bromobenzyl)thio]-5-cyclopropyl-1,2,4-triazol-4-yl]amine Formula: C12H13BrN4S MolecularWeight: 325.22742

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2N)SCC3=CC=C(C=C3)Br

Isomeric SMILES

C1CC1C2=NN=C(N2N)SCC3=CC=C(C=C3)Br

InChI

InChI=1S/C12H13BrN4S/c13-10-5-1-8(2-6-10)7-18-12-16-15-11(17(12)14)9-3-4-9/h1-2,5-6,9H,3-4,7,14H2