4-[3-(5-propan-2-ylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine

Systemtic Name: 4-[3-(5-propan-2-ylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine Openeye Name: 4-[3-(4-allyl-5-isopropylsulfanyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine CAS Name: 4-[3-[5-(propan-2-ylthio)-4-prop-2-enyl-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-(5-propan-2-ylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine Traditional Name: 4-[3-[4-allyl-5-(isopropylthio)-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine Formula: C18H24N4O3S2 MolecularWeight: 408.53816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NN=C(N1CC=C)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(C)SC1=NN=C(N1CC=C)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H24N4O3S2/c1-4-8-22-17(19-20-18(22)26-14(2)3)15-6-5-7-16(13-15)27(23,24)21-9-11-25-12-10-21/h4-7,13-14H,1,8-12H2,2-3H3