N-[4-[[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylmethyl]-1,3-thiazol-2-yl]-N-phenyl-ethanamide

Systemtic Name: N-[4-[[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylmethyl]-1,3-thiazol-2-yl]-N-phenyl-ethanamide Openeye Name: N-[4-[(4,6-diaminopyrimidin-2-yl)sulfanylmethyl]thiazol-2-yl]-N-phenyl-acetamide CAS Name: N-[4-[[(4,6-diamino-2-pyrimidinyl)thio]methyl]-2-thiazolyl]-N-phenylacetamide IUPAC Name: N-[4-[(4,6-diaminopyrimidin-2-yl)sulfanylmethyl]-1,3-thiazol-2-yl]-N-phenylacetamide Traditional Name: N-[4-[[(4,6-diaminopyrimidin-2-yl)thio]methyl]thiazol-2-yl]-N-phenyl-acetamide Formula: C16H16N6OS2 MolecularWeight: 372.46784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N6OS2/c1-10(23)22(12-5-3-2-4-6-12)16-19-11(9-25-16)8-24-15-20-13(17)7-14(18)21-15/h2-7,9H,8H2,1H3,(H4,17,18,20,21)