2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(4-phenylmethoxyphenyl)ethanamide

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(4-phenylmethoxyphenyl)ethanamide Openeye Name: N-(4-benzyloxyphenyl)-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-acetamide CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]-N-(4-phenylmethoxyphenyl)acetamide IUPAC Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-(4-phenylmethoxyphenyl)acetamide Traditional Name: N-(4-benzoxyphenyl)-2-[(4,6-diaminopyrimidin-2-yl)thio]acetamide Formula: C19H19N5O2S MolecularWeight: 381.45146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)NC(=O)CSC3=NC(=CC(=N3)N)N

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)NC(=O)CSC3=NC(=CC(=N3)N)N

InChI

InChI=1S/C19H19N5O2S/c20-16-10-17(21)24-19(23-16)27-12-18(25)22-14-6-8-15(9-7-14)26-11-13-4-2-1-3-5-13/h1-10H,11-12H2,(H,22,25)(H4,20,21,23,24)