4-[3-(4-butan-2-yl-5-ethylsulfanyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine

Systemtic Name: 4-[3-(4-butan-2-yl-5-ethylsulfanyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine Openeye Name: 4-[3-(5-ethylsulfanyl-4-sec-butyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine CAS Name: 4-[3-[4-butan-2-yl-5-(ethylthio)-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-(4-butan-2-yl-5-ethylsulfanyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine Traditional Name: 4-[3-[5-(ethylthio)-4-sec-butyl-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine Formula: C18H26N4O3S2 MolecularWeight: 410.55404

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=NN=C1SCC)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCC(C)N1C(=NN=C1SCC)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H26N4O3S2/c1-4-14(3)22-17(19-20-18(22)26-5-2)15-7-6-8-16(13-15)27(23,24)21-9-11-25-12-10-21/h6-8,13-14H,4-5,9-12H2,1-3H3