4-(naphthalen-1-ylcarbamothioylamino)benzoic acid

Systemtic Name: 4-(naphthalen-1-ylcarbamothioylamino)benzoic acid Openeye Name: 4-(1-naphthylcarbamothioylamino)benzoic acid CAS Name: 4-[[(1-naphthalenylamino)-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 4-(naphthalen-1-ylcarbamothioylamino)benzoic acid Traditional Name: 4-(1-naphthylthiocarbamoylamino)benzoic acid Formula: C18H14N2O2S MolecularWeight: 322.38096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NC(=S)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2NC(=S)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H14N2O2S/c21-17(22)13-8-10-14(11-9-13)19-18(23)20-16-7-3-5-12-4-1-2-6-15(12)16/h1-11H,(H,21,22)(H2,19,20,23)