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

Systemtic Name: N-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]-3-pyrimidin-2-ylsulfanyl-propanamide Openeye Name: N-[4-(2,4-dichlorophenyl)thiazol-2-yl]-3-pyrimidin-2-ylsulfanyl-propanamide CAS Name: N-[4-(2,4-dichlorophenyl)-2-thiazolyl]-3-(2-pyrimidinylthio)propanamide IUPAC Name: N-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]-3-pyrimidin-2-ylsulfanylpropanamide Traditional Name: N-[4-(2,4-dichlorophenyl)thiazol-2-yl]-3-(2-pyrimidylthio)propionamide Formula: C16H12Cl2N4OS2 MolecularWeight: 411.32868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCCC(=O)NC2=NC(=CS2)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CN=C(N=C1)SCCC(=O)NC2=NC(=CS2)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H12Cl2N4OS2/c17-10-2-3-11(12(18)8-10)13-9-25-16(21-13)22-14(23)4-7-24-15-19-5-1-6-20-15/h1-3,5-6,8-9H,4,7H2,(H,21,22,23)