3-[(3-bromophenyl)methylsulfanyl]-4-propan-2-yl-5-(5-propan-2-ylthiophen-3-yl)-1,2,4-triazole

Systemtic Name: 3-[(3-bromophenyl)methylsulfanyl]-4-propan-2-yl-5-(5-propan-2-ylthiophen-3-yl)-1,2,4-triazole Openeye Name: 3-[(3-bromophenyl)methylsulfanyl]-4-isopropyl-5-(5-isopropyl-3-thienyl)-1,2,4-triazole CAS Name: 3-[(3-bromophenyl)methylthio]-4-propan-2-yl-5-(5-propan-2-yl-3-thiophenyl)-1,2,4-triazole IUPAC Name: 3-[(3-bromophenyl)methylsulfanyl]-4-propan-2-yl-5-(5-propan-2-ylthiophen-3-yl)-1,2,4-triazole Traditional Name: 3-[(3-bromobenzyl)thio]-4-isopropyl-5-(5-isopropyl-3-thienyl)-1,2,4-triazole Formula: C19H22BrN3S2 MolecularWeight: 436.43208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CS1)C2=NN=C(N2C(C)C)SCC3=CC(=CC=C3)Br

Isomeric SMILES

CC(C)C1=CC(=CS1)C2=NN=C(N2C(C)C)SCC3=CC(=CC=C3)Br

InChI

InChI=1S/C19H22BrN3S2/c1-12(2)17-9-15(11-24-17)18-21-22-19(23(18)13(3)4)25-10-14-6-5-7-16(20)8-14/h5-9,11-13H,10H2,1-4H3