4-chloranyl-3-(naphthalen-1-ylcarbonylcarbamothioylamino)benzoic acid

Systemtic Name: 4-chloranyl-3-(naphthalen-1-ylcarbonylcarbamothioylamino)benzoic acid Openeye Name: 4-chloro-3-(naphthalene-1-carbonylcarbamothioylamino)benzoic acid CAS Name: 4-chloro-3-[[[[1-naphthalenyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 4-chloro-3-(naphthalene-1-carbonylcarbamothioylamino)benzoic acid Traditional Name: 4-chloro-3-(1-naphthoylthiocarbamoylamino)benzoic acid Formula: C19H13ClN2O3S MolecularWeight: 384.83612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C(=O)NC(=S)NC3=C(C=CC(=C3)C(=O)O)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C(=O)NC(=S)NC3=C(C=CC(=C3)C(=O)O)Cl

InChI

InChI=1S/C19H13ClN2O3S/c20-15-9-8-12(18(24)25)10-16(15)21-19(26)22-17(23)14-7-3-5-11-4-1-2-6-13(11)14/h1-10H,(H,24,25)(H2,21,22,23,26)