methyl 2-methyl-3-(thiolan-3-ylamino)benzoate

Systemtic Name: methyl 2-methyl-3-(thiolan-3-ylamino)benzoate Openeye Name: methyl 2-methyl-3-(tetrahydrothiophen-3-ylamino)benzoate CAS Name: 2-methyl-3-(3-thiolanylamino)benzoic acid methyl ester IUPAC Name: methyl 2-methyl-3-(thiolan-3-ylamino)benzoate Traditional Name: 2-methyl-3-(tetrahydrothiophen-3-ylamino)benzoic acid methyl ester Formula: C13H17NO2S MolecularWeight: 251.34458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC2CCSC2)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1NC2CCSC2)C(=O)OC

InChI

InChI=1S/C13H17NO2S/c1-9-11(13(15)16-2)4-3-5-12(9)14-10-6-7-17-8-10/h3-5,10,14H,6-8H2,1-2H3