methyl 2-[2-[[5-(4-bromophenyl)sulfonyl-6-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]ethanoylamino]-5-chloranyl-benzoate

Systemtic Name: methyl 2-[2-[[5-(4-bromophenyl)sulfonyl-6-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]ethanoylamino]-5-chloranyl-benzoate Openeye Name: methyl 2-[[2-[[5-(4-bromophenyl)sulfonyl-6-oxo-1H-pyrimidin-2-yl]sulfanyl]acetyl]amino]-5-chloro-benzoate CAS Name: 2-[[2-[[5-(4-bromophenyl)sulfonyl-6-oxo-1H-pyrimidin-2-yl]thio]-1-oxoethyl]amino]-5-chlorobenzoic acid methyl ester IUPAC Name: methyl 2-[[2-[[5-(4-bromophenyl)sulfonyl-6-oxo-1H-pyrimidin-2-yl]sulfanyl]acetyl]amino]-5-chlorobenzoate Traditional Name: 2-[[2-[(5-brosyl-6-keto-1H-pyrimidin-2-yl)thio]acetyl]amino]-5-chloro-benzoic acid methyl ester Formula: C20H15BrClN3O6S2 MolecularWeight: 572.8366

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)Cl)NC(=O)CSC2=NC=C(C(=O)N2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)Cl)NC(=O)CSC2=NC=C(C(=O)N2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H15BrClN3O6S2/c1-31-19(28)14-8-12(22)4-7-15(14)24-17(26)10-32-20-23-9-16(18(27)25-20)33(29,30)13-5-2-11(21)3-6-13/h2-9H,10H2,1H3,(H,24,26)(H,23,25,27)