3-(propan-2-ylcarbamothioylamino)benzoic acid

Systemtic Name: 3-(propan-2-ylcarbamothioylamino)benzoic acid Openeye Name: 3-(isopropylcarbamothioylamino)benzoic acid CAS Name: 3-[[(propan-2-ylamino)-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 3-(propan-2-ylcarbamothioylamino)benzoic acid Traditional Name: 3-(isopropylthiocarbamoylamino)benzoic acid Formula: C11H14N2O2S MolecularWeight: 238.30606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NC1=CC=CC(=C1)C(=O)O

Isomeric SMILES

CC(C)NC(=S)NC1=CC=CC(=C1)C(=O)O

InChI

InChI=1S/C11H14N2O2S/c1-7(2)12-11(16)13-9-5-3-4-8(6-9)10(14)15/h3-7H,1-2H3,(H,14,15)(H2,12,13,16)