1-[[4-azanyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-3-(4-phenylphenoxy)propan-2-ol

Systemtic Name: 1-[[4-azanyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-3-(4-phenylphenoxy)propan-2-ol Openeye Name: 1-[[4-amino-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanyl]-3-(4-phenylphenoxy)propan-2-ol CAS Name: 1-[[4-amino-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]-3-(4-phenylphenoxy)-2-propanol IUPAC Name: 1-[[4-amino-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-3-(4-phenylphenoxy)propan-2-ol Traditional Name: 1-[[4-amino-5-(2-furyl)-1,2,4-triazol-3-yl]thio]-3-(4-phenylphenoxy)propan-2-ol Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)OCC(CSC3=NN=C(N3N)C4=CC=CO4)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)OCC(CSC3=NN=C(N3N)C4=CC=CO4)O

InChI

InChI=1S/C21H20N4O3S/c22-25-20(19-7-4-12-27-19)23-24-21(25)29-14-17(26)13-28-18-10-8-16(9-11-18)15-5-2-1-3-6-15/h1-12,17,26H,13-14,22H2