2-(4-chloranyl-6-phenylazanyl-pyrimidin-2-yl)sulfanyl-N-(2-hydroxyethyl)ethanamide

Systemtic Name: 2-(4-chloranyl-6-phenylazanyl-pyrimidin-2-yl)sulfanyl-N-(2-hydroxyethyl)ethanamide Openeye Name: 2-(4-anilino-6-chloro-pyrimidin-2-yl)sulfanyl-N-(2-hydroxyethyl)acetamide CAS Name: 2-[(4-anilino-6-chloro-2-pyrimidinyl)thio]-N-(2-hydroxyethyl)acetamide IUPAC Name: 2-(4-anilino-6-chloropyrimidin-2-yl)sulfanyl-N-(2-hydroxyethyl)acetamide Traditional Name: 2-[(4-anilino-6-chloro-pyrimidin-2-yl)thio]-N-(2-hydroxyethyl)acetamide Formula: C14H15ClN4O2S MolecularWeight: 338.8125

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC(=NC(=N2)SCC(=O)NCCO)Cl

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC(=NC(=N2)SCC(=O)NCCO)Cl

InChI

InChI=1S/C14H15ClN4O2S/c15-11-8-12(17-10-4-2-1-3-5-10)19-14(18-11)22-9-13(21)16-6-7-20/h1-5,8,20H,6-7,9H2,(H,16,21)(H,17,18,19)