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

Systemtic Name: 1-[5-[(4-bromophenyl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]piperidine Openeye Name: 1-[5-[(4-bromophenyl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]piperidine CAS Name: 1-[5-[(4-bromophenyl)methylthio]-4-cyclopropyl-1,2,4-triazol-3-yl]piperidine IUPAC Name: 1-[5-[(4-bromophenyl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]piperidine Traditional Name: 1-[5-[(4-bromobenzyl)thio]-4-cyclopropyl-1,2,4-triazol-3-yl]piperidine Formula: C17H21BrN4S MolecularWeight: 393.34444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NN=C(N2C3CC3)SCC4=CC=C(C=C4)Br

Isomeric SMILES

C1CCN(CC1)C2=NN=C(N2C3CC3)SCC4=CC=C(C=C4)Br

InChI

InChI=1S/C17H21BrN4S/c18-14-6-4-13(5-7-14)12-23-17-20-19-16(22(17)15-8-9-15)21-10-2-1-3-11-21/h4-7,15H,1-3,8-12H2