3-[2-(4-morpholin-4-ylsulfonylphenoxy)ethylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[2-(4-morpholin-4-ylsulfonylphenoxy)ethylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[2-(4-morpholinosulfonylphenoxy)ethylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-[2-[4-(4-morpholinylsulfonyl)phenoxy]ethylthio]-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[2-(4-morpholin-4-ylsulfonylphenoxy)ethylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[2-(4-morpholinosulfonylphenoxy)ethylthio]-4-propyl-1H-1,2,4-triazol-5-one Formula: C17H24N4O5S2 MolecularWeight: 428.52626

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCCOC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCCN1C(=O)NN=C1SCCOC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C17H24N4O5S2/c1-2-7-21-16(22)18-19-17(21)27-13-12-26-14-3-5-15(6-4-14)28(23,24)20-8-10-25-11-9-20/h3-6H,2,7-13H2,1H3,(H,18,22)