2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-(2,3-dimethylphenyl)ethanamide

Systemtic Name: 2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-(2,3-dimethylphenyl)ethanamide Openeye Name: 2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanyl-N-(2,3-dimethylphenyl)acetamide CAS Name: 2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-N-(2,3-dimethylphenyl)acetamide IUPAC Name: 2-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl-N-(2,3-dimethylphenyl)acetamide Traditional Name: 2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]-N-(2,3-dimethylphenyl)acetamide Formula: C15H15N5OS MolecularWeight: 313.3775

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CSC2=NC=C(C(=N2)N)C#N)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CSC2=NC=C(C(=N2)N)C#N)C

InChI

InChI=1S/C15H15N5OS/c1-9-4-3-5-12(10(9)2)19-13(21)8-22-15-18-7-11(6-16)14(17)20-15/h3-5,7H,8H2,1-2H3,(H,19,21)(H2,17,18,20)