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

Systemtic Name: 4-[3-[5-(2-methylpropylsulfanyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine Openeye Name: 4-[3-(4-allyl-5-isobutylsulfanyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine CAS Name: 4-[3-[5-(2-methylpropylthio)-4-prop-2-enyl-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-[5-(2-methylpropylsulfanyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine Traditional Name: 4-[3-[4-allyl-5-(isobutylthio)-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine Formula: C19H26N4O3S2 MolecularWeight: 422.56474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NN=C(N1CC=C)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(C)CSC1=NN=C(N1CC=C)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H26N4O3S2/c1-4-8-23-18(20-21-19(23)27-14-15(2)3)16-6-5-7-17(13-16)28(24,25)22-9-11-26-12-10-22/h4-7,13,15H,1,8-12,14H2,2-3H3