1-(2-methoxy-4-prop-2-enyl-phenoxy)-3-[[4-(phenylmethyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]propan-2-ol

Systemtic Name: 1-(2-methoxy-4-prop-2-enyl-phenoxy)-3-[[4-(phenylmethyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]propan-2-ol Openeye Name: 1-(4-allyl-2-methoxy-phenoxy)-3-[[4-benzyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propan-2-ol CAS Name: 1-(2-methoxy-4-prop-2-enylphenoxy)-3-[[4-(phenylmethyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-2-propanol IUPAC Name: 1-[(4-benzyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-3-(2-methoxy-4-prop-2-enylphenoxy)propan-2-ol Traditional Name: 1-(4-allyl-2-methoxy-phenoxy)-3-[[4-benzyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]propan-2-ol Formula: C27H28N4O3S MolecularWeight: 488.60122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC=C)OCC(CSC2=NN=C(N2CC3=CC=CC=C3)C4=CN=CC=C4)O

Isomeric SMILES

COC1=C(C=CC(=C1)CC=C)OCC(CSC2=NN=C(N2CC3=CC=CC=C3)C4=CN=CC=C4)O

InChI

InChI=1S/C27H28N4O3S/c1-3-8-20-12-13-24(25(15-20)33-2)34-18-23(32)19-35-27-30-29-26(22-11-7-14-28-16-22)31(27)17-21-9-5-4-6-10-21/h3-7,9-16,23,32H,1,8,17-19H2,2H3