3-methyl-4-(2-naphthalen-2-ylsulfanylethanoylamino)benzoic acid

Systemtic Name: 3-methyl-4-(2-naphthalen-2-ylsulfanylethanoylamino)benzoic acid Openeye Name: 3-methyl-4-[[2-(2-naphthylsulfanyl)acetyl]amino]benzoic acid CAS Name: 3-methyl-4-[[2-(2-naphthalenylthio)-1-oxoethyl]amino]benzoic acid IUPAC Name: 3-methyl-4-[(2-naphthalen-2-ylsulfanylacetyl)amino]benzoic acid Traditional Name: 3-methyl-4-[[2-(2-naphthylthio)acetyl]amino]benzoic acid Formula: C20H17NO3S MolecularWeight: 351.41888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)CSC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)CSC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C20H17NO3S/c1-13-10-16(20(23)24)7-9-18(13)21-19(22)12-25-17-8-6-14-4-2-3-5-15(14)11-17/h2-11H,12H2,1H3,(H,21,22)(H,23,24)