N-[4-[2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanylethanoyl]-2-methoxy-phenyl]propanamide

Systemtic Name: N-[4-[2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanylethanoyl]-2-methoxy-phenyl]propanamide Openeye Name: N-[4-[2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanylacetyl]-2-methoxy-phenyl]propanamide CAS Name: N-[4-[2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-1-oxoethyl]-2-methoxyphenyl]propanamide IUPAC Name: N-[4-[2-(4-amino-5-cyanopyrimidin-2-yl)sulfanylacetyl]-2-methoxyphenyl]propanamide Traditional Name: N-[4-[2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]acetyl]-2-methoxy-phenyl]propionamide Formula: C17H17N5O3S MolecularWeight: 371.41358

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=C(C=C1)C(=O)CSC2=NC=C(C(=N2)N)C#N)OC

Isomeric SMILES

CCC(=O)NC1=C(C=C(C=C1)C(=O)CSC2=NC=C(C(=N2)N)C#N)OC

InChI

InChI=1S/C17H17N5O3S/c1-3-15(24)21-12-5-4-10(6-14(12)25-2)13(23)9-26-17-20-8-11(7-18)16(19)22-17/h4-6,8H,3,9H2,1-2H3,(H,21,24)(H2,19,20,22)