1,7-dicyclopropyl-5-[(2S)-1-(cyclopropylcarbamoylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-4-oxidanylidene-pyrimido[4,5-d]pyrimidin-2-olate

Systemtic Name: 1,7-dicyclopropyl-5-[(2S)-1-(cyclopropylcarbamoylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-4-oxidanylidene-pyrimido[4,5-d]pyrimidin-2-olate Openeye Name: 1,7-dicyclopropyl-5-[(1S)-2-(cyclopropylcarbamoylamino)-1-methyl-2-oxo-ethyl]sulfanyl-4-oxo-pyrimido[4,5-d]pyrimidin-2-olate CAS Name: 1,7-dicyclopropyl-5-[[(2S)-1-[[(cyclopropylamino)-oxomethyl]amino]-1-oxopropan-2-yl]thio]-4-oxo-2-pyrimido[4,5-d]pyrimidinolate IUPAC Name: 1,7-dicyclopropyl-5-[(2S)-1-(cyclopropylcarbamoylamino)-1-oxopropan-2-yl]sulfanyl-4-oxopyrimido[4,5-d]pyrimidin-2-olate Traditional Name: 1,7-dicyclopropyl-5-[[(1S)-2-(cyclopropylcarbamoylamino)-2-keto-1-methyl-ethyl]thio]-4-keto-pyrimido[4,5-d]pyrimidin-2-olate Formula: C19H21N6O4S- MolecularWeight: 429.47284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1CC1)SC2=NC(=NC3=C2C(=O)N=C(N3C4CC4)[O-])C5CC5

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC1CC1)SC2=NC(=NC3=C2C(=O)N=C(N3C4CC4)[O-])C5CC5

InChI

InChI=1S/C19H22N6O4S/c1-8(15(26)23-18(28)20-10-4-5-10)30-17-12-14(21-13(22-17)9-2-3-9)25(11-6-7-11)19(29)24-16(12)27/h8-11H,2-7H2,1H3,(H,24,27,29)(H2,20,23,26,28)/p-1/t8-/m0/s1