N-[1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-2-(4-propoxypyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-2-(4-propoxypyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-2-(4-propoxypyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[1-[(2,4-dichlorophenyl)methyl]-3-pyrazolyl]-2-[(4-propoxy-2-pyrimidinyl)thio]acetamide IUPAC Name: N-[1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-2-(4-propoxypyrimidin-2-yl)sulfanylacetamide Traditional Name: N-[1-(2,4-dichlorobenzyl)pyrazol-3-yl]-2-[(4-propoxypyrimidin-2-yl)thio]acetamide Formula: C19H19Cl2N5O2S MolecularWeight: 452.35746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NC(=NC=C1)SCC(=O)NC2=NN(C=C2)CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CCCOC1=NC(=NC=C1)SCC(=O)NC2=NN(C=C2)CC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H19Cl2N5O2S/c1-2-9-28-18-5-7-22-19(24-18)29-12-17(27)23-16-6-8-26(25-16)11-13-3-4-14(20)10-15(13)21/h3-8,10H,2,9,11-12H2,1H3,(H,23,25,27)