N'-[2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanylethanoyl]-2-(4-chloranyl-3-methyl-phenoxy)ethanehydrazide

Systemtic Name: N'-[2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanylethanoyl]-2-(4-chloranyl-3-methyl-phenoxy)ethanehydrazide Openeye Name: N'-[2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanylacetyl]-2-(4-chloro-3-methyl-phenoxy)acetohydrazide CAS Name: N'-[2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-1-oxoethyl]-2-(4-chloro-3-methylphenoxy)acetohydrazide IUPAC Name: N'-[2-(4-amino-5-cyanopyrimidin-2-yl)sulfanylacetyl]-2-(4-chloro-3-methylphenoxy)acetohydrazide Traditional Name: N'-[2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]acetyl]-2-(4-chloro-3-methyl-phenoxy)acetohydrazide Formula: C16H15ClN6O3S MolecularWeight: 406.8467

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NNC(=O)CSC2=NC=C(C(=N2)N)C#N)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NNC(=O)CSC2=NC=C(C(=N2)N)C#N)Cl

InChI

InChI=1S/C16H15ClN6O3S/c1-9-4-11(2-3-12(9)17)26-7-13(24)22-23-14(25)8-27-16-20-6-10(5-18)15(19)21-16/h2-4,6H,7-8H2,1H3,(H,22,24)(H,23,25)(H2,19,20,21)