2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-[1-(4-chlorophenyl)-2-methyl-propyl]ethanamide

Systemtic Name: 2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-[1-(4-chlorophenyl)-2-methyl-propyl]ethanamide Openeye Name: 2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanyl-N-[1-(4-chlorophenyl)-2-methyl-propyl]acetamide CAS Name: 2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-N-[1-(4-chlorophenyl)-2-methylpropyl]acetamide IUPAC Name: 2-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl-N-[1-(4-chlorophenyl)-2-methylpropyl]acetamide Traditional Name: 2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]-N-[1-(4-chlorophenyl)-2-methyl-propyl]acetamide Formula: C17H18ClN5OS MolecularWeight: 375.87572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18ClN5OS/c1-10(2)15(11-3-5-13(18)6-4-11)22-14(24)9-25-17-21-8-12(7-19)16(20)23-17/h3-6,8,10,15H,9H2,1-2H3,(H,22,24)(H2,20,21,23)