2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-[(4-methylphenyl)-thiophen-2-yl-methyl]ethanamide

Systemtic Name: 2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-[(4-methylphenyl)-thiophen-2-yl-methyl]ethanamide Openeye Name: 2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanyl-N-[p-tolyl(2-thienyl)methyl]acetamide CAS Name: 2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-N-[(4-methylphenyl)-thiophen-2-ylmethyl]acetamide IUPAC Name: 2-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl-N-[(4-methylphenyl)-thiophen-2-ylmethyl]acetamide Traditional Name: 2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]-N-[p-tolyl(2-thienyl)methyl]acetamide Formula: C19H17N5OS2 MolecularWeight: 395.50118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CSC3=NC=C(C(=N3)N)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CSC3=NC=C(C(=N3)N)C#N

InChI

InChI=1S/C19H17N5OS2/c1-12-4-6-13(7-5-12)17(15-3-2-8-26-15)23-16(25)11-27-19-22-10-14(9-20)18(21)24-19/h2-8,10,17H,11H2,1H3,(H,23,25)(H2,21,22,24)