[2-oxidanylidene-2-(pentylamino)ethyl] 2-methyl-4-phenyl-1,3-thiazole-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-(pentylamino)ethyl] 2-methyl-4-phenyl-1,3-thiazole-5-carboxylate Openeye Name: [2-oxo-2-(pentylamino)ethyl] 2-methyl-4-phenyl-thiazole-5-carboxylate CAS Name: 2-methyl-4-phenyl-5-thiazolecarboxylic acid [2-oxo-2-(pentylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentylamino)ethyl] 2-methyl-4-phenyl-1,3-thiazole-5-carboxylate Traditional Name: 2-methyl-4-phenyl-thiazole-5-carboxylic acid [2-(amylamino)-2-keto-ethyl] ester Formula: C18H22N2O3S MolecularWeight: 346.44388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)COC(=O)C1=C(N=C(S1)C)C2=CC=CC=C2

Isomeric SMILES

CCCCCNC(=O)COC(=O)C1=C(N=C(S1)C)C2=CC=CC=C2

InChI

InChI=1S/C18H22N2O3S/c1-3-4-8-11-19-15(21)12-23-18(22)17-16(20-13(2)24-17)14-9-6-5-7-10-14/h5-7,9-10H,3-4,8,11-12H2,1-2H3,(H,19,21)