3-azanyl-5-[(E)-dimethylaminomethylideneamino]sulfonyl-4-phenylsulfanyl-benzoic acid

Systemtic Name: 3-azanyl-5-[(E)-dimethylaminomethylideneamino]sulfonyl-4-phenylsulfanyl-benzoic acid Openeye Name: 3-amino-5-[(E)-dimethylaminomethyleneamino]sulfonyl-4-phenylsulfanyl-benzoic acid CAS Name: 3-amino-5-[(E)-dimethylaminomethylideneamino]sulfonyl-4-(phenylthio)benzoic acid IUPAC Name: 3-amino-5-[(E)-dimethylaminomethylideneamino]sulfonyl-4-phenylsulfanylbenzoic acid Traditional Name: 3-amino-5-[(E)-dimethylaminomethyleneamino]sulfonyl-4-(phenylthio)benzoic acid Formula: C16H17N3O4S2 MolecularWeight: 379.45388

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=NS(=O)(=O)C1=CC(=CC(=C1SC2=CC=CC=C2)N)C(=O)O

Isomeric SMILES

CN(C)/C=N/S(=O)(=O)C1=CC(=CC(=C1SC2=CC=CC=C2)N)C(=O)O

InChI

InChI=1S/C16H17N3O4S2/c1-19(2)10-18-25(22,23)14-9-11(16(20)21)8-13(17)15(14)24-12-6-4-3-5-7-12/h3-10H,17H2,1-2H3,(H,20,21)/b18-10+