3-(4-chlorophenyl)sulfanyl-N-pyrimidin-2-yl-propanamide

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-N-pyrimidin-2-yl-propanamide Openeye Name: 3-(4-chlorophenyl)sulfanyl-N-pyrimidin-2-yl-propanamide CAS Name: 3-[(4-chlorophenyl)thio]-N-(2-pyrimidinyl)propanamide IUPAC Name: 3-(4-chlorophenyl)sulfanyl-N-pyrimidin-2-ylpropanamide Traditional Name: 3-[(4-chlorophenyl)thio]-N-(2-pyrimidyl)propionamide Formula: C13H12ClN3OS MolecularWeight: 293.77188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NC(=O)CCSC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CN=C(N=C1)NC(=O)CCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H12ClN3OS/c14-10-2-4-11(5-3-10)19-9-6-12(18)17-13-15-7-1-8-16-13/h1-5,7-8H,6,9H2,(H,15,16,17,18)