2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-[1-(3,4-dimethylphenyl)ethyl]ethanamide

Systemtic Name: 2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-[1-(3,4-dimethylphenyl)ethyl]ethanamide Openeye Name: 2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanyl-N-[1-(3,4-dimethylphenyl)ethyl]acetamide CAS Name: 2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-N-[1-(3,4-dimethylphenyl)ethyl]acetamide IUPAC Name: 2-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl-N-[1-(3,4-dimethylphenyl)ethyl]acetamide Traditional Name: 2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]-N-[1-(3,4-dimethylphenyl)ethyl]acetamide Formula: C17H19N5OS MolecularWeight: 341.43066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N5OS/c1-10-4-5-13(6-11(10)2)12(3)21-15(23)9-24-17-20-8-14(7-18)16(19)22-17/h4-6,8,12H,9H2,1-3H3,(H,21,23)(H2,19,20,22)