2-[4-chloranyl-6-[(4-chlorophenyl)methylamino]pyrimidin-2-yl]sulfanylpropanoic acid

Systemtic Name: 2-[4-chloranyl-6-[(4-chlorophenyl)methylamino]pyrimidin-2-yl]sulfanylpropanoic acid Openeye Name: 2-[4-chloro-6-[(4-chlorophenyl)methylamino]pyrimidin-2-yl]sulfanylpropanoic acid CAS Name: 2-[[4-chloro-6-[(4-chlorophenyl)methylamino]-2-pyrimidinyl]thio]propanoic acid IUPAC Name: 2-[4-chloro-6-[(4-chlorophenyl)methylamino]pyrimidin-2-yl]sulfanylpropanoic acid Traditional Name: 2-[[4-chloro-6-[(4-chlorobenzyl)amino]pyrimidin-2-yl]thio]propionic acid Formula: C14H13Cl2N3O2S MolecularWeight: 358.24292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=NC(=CC(=N1)Cl)NCC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C(=O)O)SC1=NC(=CC(=N1)Cl)NCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H13Cl2N3O2S/c1-8(13(20)21)22-14-18-11(16)6-12(19-14)17-7-9-2-4-10(15)5-3-9/h2-6,8H,7H2,1H3,(H,20,21)(H,17,18,19)