2-[4-(naphthalen-1-ylcarbamothioylamino)phenyl]ethanoic acid

Systemtic Name: 2-[4-(naphthalen-1-ylcarbamothioylamino)phenyl]ethanoic acid Openeye Name: 2-[4-(1-naphthylcarbamothioylamino)phenyl]acetic acid CAS Name: 2-[4-[[(1-naphthalenylamino)-sulfanylidenemethyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-(naphthalen-1-ylcarbamothioylamino)phenyl]acetic acid Traditional Name: 2-[4-(1-naphthylthiocarbamoylamino)phenyl]acetic acid Formula: C19H16N2O2S MolecularWeight: 336.40754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16N2O2S/c22-18(23)12-13-8-10-15(11-9-13)20-19(24)21-17-7-3-5-14-4-1-2-6-16(14)17/h1-11H,12H2,(H,22,23)(H2,20,21,24)