2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-(2,6-diethylphenyl)ethanamide

Systemtic Name: 2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-(2,6-diethylphenyl)ethanamide Openeye Name: 2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanyl-N-(2,6-diethylphenyl)acetamide CAS Name: 2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-N-(2,6-diethylphenyl)acetamide IUPAC Name: 2-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl-N-(2,6-diethylphenyl)acetamide Traditional Name: 2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]-N-(2,6-diethylphenyl)acetamide Formula: C17H19N5OS MolecularWeight: 341.43066

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CSC2=NC=C(C(=N2)N)C#N

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CSC2=NC=C(C(=N2)N)C#N

InChI

InChI=1S/C17H19N5OS/c1-3-11-6-5-7-12(4-2)15(11)21-14(23)10-24-17-20-9-13(8-18)16(19)22-17/h5-7,9H,3-4,10H2,1-2H3,(H,21,23)(H2,19,20,22)