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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCCO2)C(=O)CSC3=NC(=CC(=N3)N)N

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCCO2)C(=O)CSC3=NC(=CC(=N3)N)N

InChI

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