cyclohexyl 3-[[3,4-bis(chloranyl)-1,2-thiazol-5-yl]carbonylamino]benzoate

Systemtic Name: cyclohexyl 3-[[3,4-bis(chloranyl)-1,2-thiazol-5-yl]carbonylamino]benzoate Openeye Name: cyclohexyl 3-[(3,4-dichloroisothiazole-5-carbonyl)amino]benzoate CAS Name: 3-[[(3,4-dichloro-5-isothiazolyl)-oxomethyl]amino]benzoic acid cyclohexyl ester IUPAC Name: cyclohexyl 3-[(3,4-dichloro-1,2-thiazole-5-carbonyl)amino]benzoate Traditional Name: 3-[(3,4-dichloroisothiazole-5-carbonyl)amino]benzoic acid cyclohexyl ester Formula: C17H16Cl2N2O3S MolecularWeight: 399.29154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2=CC(=CC=C2)NC(=O)C3=C(C(=NS3)Cl)Cl

Isomeric SMILES

C1CCC(CC1)OC(=O)C2=CC(=CC=C2)NC(=O)C3=C(C(=NS3)Cl)Cl

InChI

InChI=1S/C17H16Cl2N2O3S/c18-13-14(25-21-15(13)19)16(22)20-11-6-4-5-10(9-11)17(23)24-12-7-2-1-3-8-12/h4-6,9,12H,1-3,7-8H2,(H,20,22)