6-methyl-2-[2-[[4-(4-methylpyrimidin-2-yl)azanidylsulfonylphenyl]amino]-2-oxidanylidene-ethyl]sulfanyl-pyrimidin-4-olate

Systemtic Name: 6-methyl-2-[2-[[4-(4-methylpyrimidin-2-yl)azanidylsulfonylphenyl]amino]-2-oxidanylidene-ethyl]sulfanyl-pyrimidin-4-olate Openeye Name: 6-methyl-2-[2-[4-(4-methylpyrimidin-2-yl)azanidylsulfonylanilino]-2-oxo-ethyl]sulfanyl-pyrimidin-4-olate CAS Name: 6-methyl-2-[[2-[4-[(4-methyl-2-pyrimidinyl)azanidylsulfonyl]anilino]-2-oxoethyl]thio]-4-pyrimidinolate IUPAC Name: 6-methyl-2-[2-[4-(4-methylpyrimidin-2-yl)azanidylsulfonylanilino]-2-oxoethyl]sulfanylpyrimidin-4-olate Traditional Name: 2-[[2-keto-2-[4-(4-methylpyrimidin-2-yl)azanidylsulfonylanilino]ethyl]thio]-6-methyl-pyrimidin-4-olate Formula: C18H16N6O4S2-2 MolecularWeight: 444.48744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC(=CC(=N3)[O-])C

Isomeric SMILES

CC1=NC(=NC=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC(=CC(=N3)[O-])C

InChI

InChI=1S/C18H18N6O4S2/c1-11-7-8-19-17(20-11)24-30(27,28)14-5-3-13(4-6-14)22-16(26)10-29-18-21-12(2)9-15(25)23-18/h3-9H,10H2,1-2H3,(H3,19,20,21,22,23,24,25,26)/p-2