(1S,2S)-2-[[3-(1,3-thiazol-2-ylcarbamoyl)phenyl]carbamoyl]cyclohexane-1-carboxylate

Systemtic Name: (1S,2S)-2-[[3-(1,3-thiazol-2-ylcarbamoyl)phenyl]carbamoyl]cyclohexane-1-carboxylate Openeye Name: (1S,2S)-2-[[3-(thiazol-2-ylcarbamoyl)phenyl]carbamoyl]cyclohexanecarboxylate CAS Name: (1S,2S)-2-[oxo-[3-[oxo-(2-thiazolylamino)methyl]anilino]methyl]-1-cyclohexanecarboxylate IUPAC Name: (1S,2S)-2-[[3-(1,3-thiazol-2-ylcarbamoyl)phenyl]carbamoyl]cyclohexane-1-carboxylate Traditional Name: (1S,2S)-2-[[3-(thiazol-2-ylcarbamoyl)phenyl]carbamoyl]cyclohexanecarboxylate Formula: C18H18N3O4S- MolecularWeight: 372.41822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NC2=CC=CC(=C2)C(=O)NC3=NC=CS3)C(=O)[O-]

Isomeric SMILES

C1CC[C@@H]([C@H](C1)C(=O)NC2=CC=CC(=C2)C(=O)NC3=NC=CS3)C(=O)[O-]

InChI

InChI=1S/C18H19N3O4S/c22-15(21-18-19-8-9-26-18)11-4-3-5-12(10-11)20-16(23)13-6-1-2-7-14(13)17(24)25/h3-5,8-10,13-14H,1-2,6-7H2,(H,20,23)(H,24,25)(H,19,21,22)/p-1/t13-,14-/m0/s1