2-[2-[(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyrimidin-4-olate

Systemtic Name: 2-[2-[(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyrimidin-4-olate Openeye Name: 2-[2-(2-chloro-5-morpholinosulfonyl-anilino)-2-oxo-ethyl]sulfanylpyrimidin-4-olate CAS Name: 2-[[2-[2-chloro-5-(4-morpholinylsulfonyl)anilino]-2-oxoethyl]thio]-4-pyrimidinolate IUPAC Name: 2-[2-(2-chloro-5-morpholin-4-ylsulfonylanilino)-2-oxoethyl]sulfanylpyrimidin-4-olate Traditional Name: 2-[[2-(2-chloro-5-morpholinosulfonyl-anilino)-2-keto-ethyl]thio]pyrimidin-4-olate Formula: C16H16ClN4O5S2- MolecularWeight: 443.90504

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)CSC3=NC=CC(=N3)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)CSC3=NC=CC(=N3)[O-]

InChI

InChI=1S/C16H17ClN4O5S2/c17-12-2-1-11(28(24,25)21-5-7-26-8-6-21)9-13(12)19-15(23)10-27-16-18-4-3-14(22)20-16/h1-4,9H,5-8,10H2,(H,19,23)(H,18,20,22)/p-1