3-(2-bromophenyl)-5-(cyclohexylmethylsulfanyl)-4-phenyl-1,2,4-triazole

Systemtic Name: 3-(2-bromophenyl)-5-(cyclohexylmethylsulfanyl)-4-phenyl-1,2,4-triazole Openeye Name: 3-(2-bromophenyl)-5-(cyclohexylmethylsulfanyl)-4-phenyl-1,2,4-triazole CAS Name: 3-(2-bromophenyl)-5-(cyclohexylmethylthio)-4-phenyl-1,2,4-triazole IUPAC Name: 3-(2-bromophenyl)-5-(cyclohexylmethylsulfanyl)-4-phenyl-1,2,4-triazole Traditional Name: 3-(2-bromophenyl)-5-(cyclohexylmethylthio)-4-phenyl-1,2,4-triazole Formula: C21H22BrN3S MolecularWeight: 428.38848

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4Br

Isomeric SMILES

C1CCC(CC1)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4Br

InChI

InChI=1S/C21H22BrN3S/c22-19-14-8-7-13-18(19)20-23-24-21(25(20)17-11-5-2-6-12-17)26-15-16-9-3-1-4-10-16/h2,5-8,11-14,16H,1,3-4,9-10,15H2