1-[4-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]but-2-ynyl]piperidine

Systemtic Name: 1-[4-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]but-2-ynyl]piperidine Openeye Name: 1-[4-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]but-2-ynyl]piperidine CAS Name: 1-[4-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]but-2-ynyl]piperidine IUPAC Name: 1-[4-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]but-2-ynyl]piperidine Traditional Name: 1-[4-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]but-2-ynyl]piperidine Formula: C23H24N4S MolecularWeight: 388.52846

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC#CCSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)CC#CCSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H24N4S/c1-4-12-20(13-5-1)22-24-25-23(27(22)21-14-6-2-7-15-21)28-19-11-10-18-26-16-8-3-9-17-26/h1-2,4-7,12-15H,3,8-9,16-19H2