5,6-bis(azanyl)-2-[2-(3-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-1H-pyrimidin-4-one

Systemtic Name: 5,6-bis(azanyl)-2-[2-(3-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-1H-pyrimidin-4-one Openeye Name: 5,6-diamino-2-[2-(3-methyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-1H-pyrimidin-4-one CAS Name: 5,6-diamino-2-[[2-(3-methyl-1-piperidinyl)-2-oxoethyl]thio]-1H-pyrimidin-4-one IUPAC Name: 5,6-diamino-2-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl-1H-pyrimidin-4-one Traditional Name: 5,6-diamino-2-[[2-keto-2-(3-methylpiperidino)ethyl]thio]-1H-pyrimidin-4-one Formula: C12H19N5O2S MolecularWeight: 297.37656

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CSC2=NC(=O)C(=C(N2)N)N

Isomeric SMILES

CC1CCCN(C1)C(=O)CSC2=NC(=O)C(=C(N2)N)N

InChI

InChI=1S/C12H19N5O2S/c1-7-3-2-4-17(5-7)8(18)6-20-12-15-10(14)9(13)11(19)16-12/h7H,2-6,13H2,1H3,(H3,14,15,16,19)