(2R)-1-(2-methylphenoxy)-3-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propan-2-ol

Systemtic Name: (2R)-1-(2-methylphenoxy)-3-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propan-2-ol Openeye Name: (2R)-1-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-3-(2-methylphenoxy)propan-2-ol CAS Name: (2R)-1-(2-methylphenoxy)-3-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]-2-propanol IUPAC Name: (2R)-1-(2-methylphenoxy)-3-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propan-2-ol Traditional Name: (2R)-1-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)thio]-3-(2-methylphenoxy)propan-2-ol Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(CSC2=NN=C(N2CC=C)C3=CC=CC=C3)O

Isomeric SMILES

CC1=CC=CC=C1OC[C@H](CSC2=NN=C(N2CC=C)C3=CC=CC=C3)O

InChI

InChI=1S/C21H23N3O2S/c1-3-13-24-20(17-10-5-4-6-11-17)22-23-21(24)27-15-18(25)14-26-19-12-8-7-9-16(19)2/h3-12,18,25H,1,13-15H2,2H3/t18-/m1/s1