2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-(3-chloranyl-4-methoxy-phenyl)ethanamide

Systemtic Name: 2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-(3-chloranyl-4-methoxy-phenyl)ethanamide Openeye Name: 2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanyl-N-(3-chloro-4-methoxy-phenyl)acetamide CAS Name: 2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-N-(3-chloro-4-methoxyphenyl)acetamide IUPAC Name: 2-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl-N-(3-chloro-4-methoxyphenyl)acetamide Traditional Name: 2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]-N-(3-chloro-4-methoxy-phenyl)acetamide Formula: C14H12ClN5O2S MolecularWeight: 349.79538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CSC2=NC=C(C(=N2)N)C#N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CSC2=NC=C(C(=N2)N)C#N)Cl

InChI

InChI=1S/C14H12ClN5O2S/c1-22-11-3-2-9(4-10(11)15)19-12(21)7-23-14-18-6-8(5-16)13(17)20-14/h2-4,6H,7H2,1H3,(H,19,21)(H2,17,18,20)