2-(2-aminophenyl)sulfanyl-4-chloranyl-5-morpholin-4-ylsulfonyl-benzoic acid

Systemtic Name: 2-(2-aminophenyl)sulfanyl-4-chloranyl-5-morpholin-4-ylsulfonyl-benzoic acid Openeye Name: 2-(2-aminophenyl)sulfanyl-4-chloro-5-morpholinosulfonyl-benzoic acid CAS Name: 2-[(2-aminophenyl)thio]-4-chloro-5-(4-morpholinylsulfonyl)benzoic acid IUPAC Name: 2-(2-aminophenyl)sulfanyl-4-chloro-5-morpholin-4-ylsulfonylbenzoic acid Traditional Name: 2-[(2-aminophenyl)thio]-4-chloro-5-morpholinosulfonyl-benzoic acid Formula: C17H17ClN2O5S2 MolecularWeight: 428.91028

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=C(C(=C2)C(=O)O)SC3=CC=CC=C3N)Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=C(C(=C2)C(=O)O)SC3=CC=CC=C3N)Cl

InChI

InChI=1S/C17H17ClN2O5S2/c18-12-10-15(26-14-4-2-1-3-13(14)19)11(17(21)22)9-16(12)27(23,24)20-5-7-25-8-6-20/h1-4,9-10H,5-8,19H2,(H,21,22)