[2-acetamido-5-(phenylsulfonyloxy)phenyl]sulfanylcarbamoylcarbamic acid

Systemtic Name: [2-acetamido-5-(phenylsulfonyloxy)phenyl]sulfanylcarbamoylcarbamic acid Openeye Name: [2-acetamido-5-(benzenesulfonyloxy)phenyl]sulfanylcarbamoylcarbamic acid CAS Name: [[[[2-acetamido-5-(benzenesulfonyloxy)phenyl]thio]amino]-oxomethyl]carbamic acid IUPAC Name: [2-acetamido-5-(benzenesulfonyloxy)phenyl]sulfanylcarbamoylcarbamic acid Traditional Name: [(2-acetamido-5-besyloxy-phenyl)thio]carbamoylcarbamic acid Formula: C16H15N3O7S2 MolecularWeight: 425.4362

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)OS(=O)(=O)C2=CC=CC=C2)SNC(=O)NC(=O)O

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)OS(=O)(=O)C2=CC=CC=C2)SNC(=O)NC(=O)O

InChI

InChI=1S/C16H15N3O7S2/c1-10(20)17-13-8-7-11(9-14(13)27-19-15(21)18-16(22)23)26-28(24,25)12-5-3-2-4-6-12/h2-9H,1H3,(H,17,20)(H,22,23)(H2,18,19,21)