methyl 3-[5-phenylmethoxy-6-[(4-propan-2-yl-1,3-thiazol-2-yl)amino]pyridin-3-yl]sulfanylpropanoate

Systemtic Name: methyl 3-[5-phenylmethoxy-6-[(4-propan-2-yl-1,3-thiazol-2-yl)amino]pyridin-3-yl]sulfanylpropanoate Openeye Name: methyl 3-[[5-benzyloxy-6-[(4-isopropylthiazol-2-yl)amino]-3-pyridyl]sulfanyl]propanoate CAS Name: 3-[[5-phenylmethoxy-6-[(4-propan-2-yl-2-thiazolyl)amino]-3-pyridinyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[5-phenylmethoxy-6-[(4-propan-2-yl-1,3-thiazol-2-yl)amino]pyridin-3-yl]sulfanylpropanoate Traditional Name: 3-[[5-benzoxy-6-[(4-isopropylthiazol-2-yl)amino]-3-pyridyl]thio]propionic acid methyl ester Formula: C22H25N3O3S2 MolecularWeight: 443.5822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CSC(=N1)NC2=NC=C(C=C2OCC3=CC=CC=C3)SCCC(=O)OC

Isomeric SMILES

CC(C)C1=CSC(=N1)NC2=NC=C(C=C2OCC3=CC=CC=C3)SCCC(=O)OC

InChI

InChI=1S/C22H25N3O3S2/c1-15(2)18-14-30-22(24-18)25-21-19(28-13-16-7-5-4-6-8-16)11-17(12-23-21)29-10-9-20(26)27-3/h4-8,11-12,14-15H,9-10,13H2,1-3H3,(H,23,24,25)