N-(4-azanyl-2-chloranyl-phenyl)-3-pyrimidin-2-ylsulfanyl-propanamide

Systemtic Name: N-(4-azanyl-2-chloranyl-phenyl)-3-pyrimidin-2-ylsulfanyl-propanamide Openeye Name: N-(4-amino-2-chloro-phenyl)-3-pyrimidin-2-ylsulfanyl-propanamide CAS Name: N-(4-amino-2-chlorophenyl)-3-(2-pyrimidinylthio)propanamide IUPAC Name: N-(4-amino-2-chlorophenyl)-3-pyrimidin-2-ylsulfanylpropanamide Traditional Name: N-(4-amino-2-chloro-phenyl)-3-(2-pyrimidylthio)propionamide Formula: C13H13ClN4OS MolecularWeight: 308.78652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCCC(=O)NC2=C(C=C(C=C2)N)Cl

Isomeric SMILES

C1=CN=C(N=C1)SCCC(=O)NC2=C(C=C(C=C2)N)Cl

InChI

InChI=1S/C13H13ClN4OS/c14-10-8-9(15)2-3-11(10)18-12(19)4-7-20-13-16-5-1-6-17-13/h1-3,5-6,8H,4,7,15H2,(H,18,19)