2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-ethanamide

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-ethanamide Openeye Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-acetamide CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methylacetamide IUPAC Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methylacetamide Traditional Name: 2-[(4,6-diaminopyrimidin-2-yl)thio]-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-acetamide Formula: C16H19N5O3S MolecularWeight: 361.41876

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1COC2=CC=CC=C2O1)C(=O)CSC3=NC(=CC(=N3)N)N

Isomeric SMILES

CN(CC1COC2=CC=CC=C2O1)C(=O)CSC3=NC(=CC(=N3)N)N

InChI

InChI=1S/C16H19N5O3S/c1-21(7-10-8-23-11-4-2-3-5-12(11)24-10)15(22)9-25-16-19-13(17)6-14(18)20-16/h2-6,10H,7-9H2,1H3,(H4,17,18,19,20)