(1R,2R)-2-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamoyl]cyclohexane-1-carboxylate

Systemtic Name: (1R,2R)-2-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamoyl]cyclohexane-1-carboxylate Openeye Name: (1R,2R)-2-[[4-(p-tolyl)thiazol-2-yl]carbamoyl]cyclohexanecarboxylate CAS Name: (1R,2R)-2-[[[4-(4-methylphenyl)-2-thiazolyl]amino]-oxomethyl]-1-cyclohexanecarboxylate IUPAC Name: (1R,2R)-2-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamoyl]cyclohexane-1-carboxylate Traditional Name: (1R,2R)-2-[[4-(p-tolyl)thiazol-2-yl]carbamoyl]cyclohexanecarboxylate Formula: C18H19N2O3S- MolecularWeight: 343.42006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3CCCCC3C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)[C@@H]3CCCC[C@H]3C(=O)[O-]

InChI

InChI=1S/C18H20N2O3S/c1-11-6-8-12(9-7-11)15-10-24-18(19-15)20-16(21)13-4-2-3-5-14(13)17(22)23/h6-10,13-14H,2-5H2,1H3,(H,22,23)(H,19,20,21)/p-1/t13-,14-/m1/s1