2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-[1-(2,4-dichlorophenyl)ethyl]propanamide

Systemtic Name: 2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-[1-(2,4-dichlorophenyl)ethyl]propanamide Openeye Name: 2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanyl-N-[1-(2,4-dichlorophenyl)ethyl]propanamide CAS Name: 2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-N-[1-(2,4-dichlorophenyl)ethyl]propanamide IUPAC Name: 2-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl-N-[1-(2,4-dichlorophenyl)ethyl]propanamide Traditional Name: 2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]-N-[1-(2,4-dichlorophenyl)ethyl]propionamide Formula: C16H15Cl2N5OS MolecularWeight: 396.2942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)Cl)Cl)NC(=O)C(C)SC2=NC=C(C(=N2)N)C#N

Isomeric SMILES

CC(C1=C(C=C(C=C1)Cl)Cl)NC(=O)C(C)SC2=NC=C(C(=N2)N)C#N

InChI

InChI=1S/C16H15Cl2N5OS/c1-8(12-4-3-11(17)5-13(12)18)22-15(24)9(2)25-16-21-7-10(6-19)14(20)23-16/h3-5,7-9H,1-2H3,(H,22,24)(H2,20,21,23)