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

Systemtic Name: 1-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-3-(4-ethylphenoxy)propan-2-ol Openeye Name: 1-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-3-(4-ethylphenoxy)propan-2-ol CAS Name: 1-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]-3-(4-ethylphenoxy)-2-propanol IUPAC Name: 1-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-3-(4-ethylphenoxy)propan-2-ol Traditional Name: 1-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]-3-(4-ethylphenoxy)propan-2-ol Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(CSC2=NN=C(N2C3=CC=CC=C3)C4CC4)O

Isomeric SMILES

CCC1=CC=C(C=C1)OCC(CSC2=NN=C(N2C3=CC=CC=C3)C4CC4)O

InChI

InChI=1S/C22H25N3O2S/c1-2-16-8-12-20(13-9-16)27-14-19(26)15-28-22-24-23-21(17-10-11-17)25(22)18-6-4-3-5-7-18/h3-9,12-13,17,19,26H,2,10-11,14-15H2,1H3