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

Systemtic Name: N-(3-azanyl-4-chloranyl-phenyl)-4-pyrimidin-2-ylsulfanyl-butanamide Openeye Name: N-(3-amino-4-chloro-phenyl)-4-pyrimidin-2-ylsulfanyl-butanamide CAS Name: N-(3-amino-4-chlorophenyl)-4-(2-pyrimidinylthio)butanamide IUPAC Name: N-(3-amino-4-chlorophenyl)-4-pyrimidin-2-ylsulfanylbutanamide Traditional Name: N-(3-amino-4-chloro-phenyl)-4-(2-pyrimidylthio)butyramide Formula: C14H15ClN4OS MolecularWeight: 322.8131

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCCCC(=O)NC2=CC(=C(C=C2)Cl)N

Isomeric SMILES

C1=CN=C(N=C1)SCCCC(=O)NC2=CC(=C(C=C2)Cl)N

InChI

InChI=1S/C14H15ClN4OS/c15-11-5-4-10(9-12(11)16)19-13(20)3-1-8-21-14-17-6-2-7-18-14/h2,4-7,9H,1,3,8,16H2,(H,19,20)