2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(5-chloranyl-2-methoxy-phenyl)propanamide

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(5-chloranyl-2-methoxy-phenyl)propanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-propanamide CAS Name: N-(5-chloro-2-methoxyphenyl)-2-[(4,6-diamino-2-pyrimidinyl)thio]propanamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-2-(4,6-diaminopyrimidin-2-yl)sulfanylpropanamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-2-[(4,6-diaminopyrimidin-2-yl)thio]propionamide Formula: C14H16ClN5O2S MolecularWeight: 353.82714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)Cl)OC)SC2=NC(=CC(=N2)N)N

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)Cl)OC)SC2=NC(=CC(=N2)N)N

InChI

InChI=1S/C14H16ClN5O2S/c1-7(23-14-19-11(16)6-12(17)20-14)13(21)18-9-5-8(15)3-4-10(9)22-2/h3-7H,1-2H3,(H,18,21)(H4,16,17,19,20)