4-[3-[4-cyclopentyl-5-(3-methylbutylsulfanyl)-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine

Systemtic Name: 4-[3-[4-cyclopentyl-5-(3-methylbutylsulfanyl)-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine Openeye Name: 4-[3-(4-cyclopentyl-5-isopentylsulfanyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine CAS Name: 4-[3-[4-cyclopentyl-5-(3-methylbutylthio)-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-[4-cyclopentyl-5-(3-methylbutylsulfanyl)-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine Traditional Name: 4-[3-[4-cyclopentyl-5-(isoamylthio)-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine Formula: C22H32N4O3S2 MolecularWeight: 464.64448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=NN=C(N1C2CCCC2)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC(C)CCSC1=NN=C(N1C2CCCC2)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H32N4O3S2/c1-17(2)10-15-30-22-24-23-21(26(22)19-7-3-4-8-19)18-6-5-9-20(16-18)31(27,28)25-11-13-29-14-12-25/h5-6,9,16-17,19H,3-4,7-8,10-15H2,1-2H3