N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-pyrimidin-2-ylsulfanyl-propanamide

Systemtic Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-pyrimidin-2-ylsulfanyl-propanamide Openeye Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-2-pyrimidin-2-ylsulfanyl-propanamide CAS Name: N-[4-(3,4-dimethoxyphenyl)-2-thiazolyl]-2-(2-pyrimidinylthio)propanamide IUPAC Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-pyrimidin-2-ylsulfanylpropanamide Traditional Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-2-(2-pyrimidylthio)propionamide Formula: C18H18N4O3S2 MolecularWeight: 402.49052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC(=CS1)C2=CC(=C(C=C2)OC)OC)SC3=NC=CC=N3

Isomeric SMILES

CC(C(=O)NC1=NC(=CS1)C2=CC(=C(C=C2)OC)OC)SC3=NC=CC=N3

InChI

InChI=1S/C18H18N4O3S2/c1-11(27-17-19-7-4-8-20-17)16(23)22-18-21-13(10-26-18)12-5-6-14(24-2)15(9-12)25-3/h4-11H,1-3H3,(H,21,22,23)