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

Systemtic Name: 4-[3-(4-cyclopentyl-5-phenethylsulfanyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine Openeye Name: 4-[3-(4-cyclopentyl-5-phenethylsulfanyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine CAS Name: 4-[3-[4-cyclopentyl-5-(phenethylthio)-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-(4-cyclopentyl-5-phenethylsulfanyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine Traditional Name: 4-[3-[4-cyclopentyl-5-(phenethylthio)-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine Formula: C25H30N4O3S2 MolecularWeight: 498.6607

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=NN=C2SCCC3=CC=CC=C3)C4=CC(=CC=C4)S(=O)(=O)N5CCOCC5

Isomeric SMILES

C1CCC(C1)N2C(=NN=C2SCCC3=CC=CC=C3)C4=CC(=CC=C4)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C25H30N4O3S2/c30-34(31,28-14-16-32-17-15-28)23-12-6-9-21(19-23)24-26-27-25(29(24)22-10-4-5-11-22)33-18-13-20-7-2-1-3-8-20/h1-3,6-9,12,19,22H,4-5,10-11,13-18H2