(E)-3-[[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]sulfanyl]-4-oxidanyl-pent-3-en-2-one

Systemtic Name: (E)-3-[[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]sulfanyl]-4-oxidanyl-pent-3-en-2-one Openeye Name: (E)-3-[[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]sulfanyl]-4-hydroxy-pent-3-en-2-one CAS Name: (E)-3-[[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]thio]-4-hydroxy-3-penten-2-one IUPAC Name: (E)-3-[[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]sulfanyl]-4-hydroxypent-3-en-2-one Traditional Name: (E)-3-[[4,6-bis(ethylamino)-s-triazin-2-yl]thio]-4-hydroxy-pent-3-en-2-one Formula: C12H19N5O2S MolecularWeight: 297.37656

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC(=N1)SC(=C(C)O)C(=O)C)NCC

Isomeric SMILES

CCNC1=NC(=NC(=N1)S/C(=C(\C)/O)/C(=O)C)NCC

InChI

InChI=1S/C12H19N5O2S/c1-5-13-10-15-11(14-6-2)17-12(16-10)20-9(7(3)18)8(4)19/h18H,5-6H2,1-4H3,(H2,13,14,15,16,17)/b9-7+