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

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(phenylmethyl)-N-propan-2-yl-ethanamide Openeye Name: N-benzyl-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-isopropyl-acetamide CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]-N-(phenylmethyl)-N-propan-2-ylacetamide IUPAC Name: N-benzyl-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-propan-2-ylacetamide Traditional Name: N-benzyl-2-[(4,6-diaminopyrimidin-2-yl)thio]-N-isopropyl-acetamide Formula: C16H21N5OS MolecularWeight: 331.43584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)C(=O)CSC2=NC(=CC(=N2)N)N

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)C(=O)CSC2=NC(=CC(=N2)N)N

InChI

InChI=1S/C16H21N5OS/c1-11(2)21(9-12-6-4-3-5-7-12)15(22)10-23-16-19-13(17)8-14(18)20-16/h3-8,11H,9-10H2,1-2H3,(H4,17,18,19,20)