3,5-bis(chloranyl)-2-(naphthalen-1-ylcarbonylcarbamothioylamino)benzoic acid

Systemtic Name: 3,5-bis(chloranyl)-2-(naphthalen-1-ylcarbonylcarbamothioylamino)benzoic acid Openeye Name: 3,5-dichloro-2-(naphthalene-1-carbonylcarbamothioylamino)benzoic acid CAS Name: 3,5-dichloro-2-[[[[1-naphthalenyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 3,5-dichloro-2-(naphthalene-1-carbonylcarbamothioylamino)benzoic acid Traditional Name: 3,5-dichloro-2-(1-naphthoylthiocarbamoylamino)benzoic acid Formula: C19H12Cl2N2O3S MolecularWeight: 419.28118

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C(=O)NC(=S)NC3=C(C=C(C=C3C(=O)O)Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C(=O)NC(=S)NC3=C(C=C(C=C3C(=O)O)Cl)Cl

InChI

InChI=1S/C19H12Cl2N2O3S/c20-11-8-14(18(25)26)16(15(21)9-11)22-19(27)23-17(24)13-7-3-5-10-4-1-2-6-12(10)13/h1-9H,(H,25,26)(H2,22,23,24,27)