[(2R)-2-[(4-chlorophenyl)carbamoylamino]-3-oxidanylidene-3-[[4-(3-oxidanylidenemorpholin-4-yl)phenyl]amino]propyl] sulfamate

Systemtic Name: [(2R)-2-[(4-chlorophenyl)carbamoylamino]-3-oxidanylidene-3-[[4-(3-oxidanylidenemorpholin-4-yl)phenyl]amino]propyl] sulfamate Openeye Name: [(2R)-2-[(4-chlorophenyl)carbamoylamino]-3-oxo-3-[4-(3-oxomorpholin-4-yl)anilino]propyl] sulfamate CAS Name: sulfamic acid [(2R)-2-[[(4-chloroanilino)-oxomethyl]amino]-3-oxo-3-[4-(3-oxo-4-morpholinyl)anilino]propyl] ester IUPAC Name: [(2R)-2-[(4-chlorophenyl)carbamoylamino]-3-oxo-3-[4-(3-oxomorpholin-4-yl)anilino]propyl] sulfamate Traditional Name: sulfamic acid [(2R)-2-[(4-chlorophenyl)carbamoylamino]-3-keto-3-[4-(3-ketomorpholino)anilino]propyl] ester Formula: C20H22ClN5O7S MolecularWeight: 511.93598

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC(=O)N1C2=CC=C(C=C2)NC(=O)C(COS(=O)(=O)N)NC(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1COCC(=O)N1C2=CC=C(C=C2)NC(=O)[C@@H](COS(=O)(=O)N)NC(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H22ClN5O7S/c21-13-1-3-15(4-2-13)24-20(29)25-17(11-33-34(22,30)31)19(28)23-14-5-7-16(8-6-14)26-9-10-32-12-18(26)27/h1-8,17H,9-12H2,(H,23,28)(H2,22,30,31)(H2,24,25,29)/t17-/m1/s1