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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(CSC2=NN(C(=N2)C3CC3)C4=CC=CC=C4)O

Isomeric SMILES

CC1=CC(=CC=C1)OC[C@H](CSC2=NN(C(=N2)C3CC3)C4=CC=CC=C4)O

InChI

InChI=1S/C21H23N3O2S/c1-15-6-5-9-19(12-15)26-13-18(25)14-27-21-22-20(16-10-11-16)24(23-21)17-7-3-2-4-8-17/h2-9,12,16,18,25H,10-11,13-14H2,1H3/t18-/m1/s1