(1R,6S)-3,4-dimethyl-6-[(4-methyl-1,3-thiazol-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: (1R,6S)-3,4-dimethyl-6-[(4-methyl-1,3-thiazol-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: (1R,6S)-3,4-dimethyl-6-[(4-methylthiazol-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: (1R,6S)-3,4-dimethyl-6-[[(4-methyl-2-thiazolyl)amino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: (1R,6S)-3,4-dimethyl-6-[(4-methyl-1,3-thiazol-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: (1R,6S)-3,4-dimethyl-6-[(4-methylthiazol-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C14H18N2O3S MolecularWeight: 294.36932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(C1)C(=O)NC2=NC(=CS2)C)C(=O)O)C

Isomeric SMILES

CC1=C(C[C@H]([C@H](C1)C(=O)NC2=NC(=CS2)C)C(=O)O)C

InChI

InChI=1S/C14H18N2O3S/c1-7-4-10(11(13(18)19)5-8(7)2)12(17)16-14-15-9(3)6-20-14/h6,10-11H,4-5H2,1-3H3,(H,18,19)(H,15,16,17)/t10-,11+/m0/s1