3-[(4-carbamothioylphenyl)carbonylamino]-4-(naphthalen-2-ylsulfonylamino)benzoic acid

Systemtic Name: 3-[(4-carbamothioylphenyl)carbonylamino]-4-(naphthalen-2-ylsulfonylamino)benzoic acid Openeye Name: 3-[(4-carbamothioylbenzoyl)amino]-4-(2-naphthylsulfonylamino)benzoic acid CAS Name: 3-[[(4-carbamothioylphenyl)-oxomethyl]amino]-4-(2-naphthalenylsulfonylamino)benzoic acid IUPAC Name: 3-[(4-carbamothioylbenzoyl)amino]-4-(naphthalen-2-ylsulfonylamino)benzoic acid Traditional Name: 4-(2-naphthylsulfonylamino)-3-[(4-thiocarbamoylbenzoyl)amino]benzoic acid Formula: C25H19N3O5S2 MolecularWeight: 505.56546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)NC3=C(C=C(C=C3)C(=O)O)NC(=O)C4=CC=C(C=C4)C(=S)N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)NC3=C(C=C(C=C3)C(=O)O)NC(=O)C4=CC=C(C=C4)C(=S)N

InChI

InChI=1S/C25H19N3O5S2/c26-23(34)16-5-7-17(8-6-16)24(29)27-22-14-19(25(30)31)10-12-21(22)28-35(32,33)20-11-9-15-3-1-2-4-18(15)13-20/h1-14,28H,(H2,26,34)(H,27,29)(H,30,31)