ethyl 2-[[tert-butyl(naphthalen-1-ylcarbamoyl)amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[[tert-butyl(naphthalen-1-ylcarbamoyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[tert-butyl(1-naphthylcarbamoyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[tert-butyl-[(1-naphthalenylamino)-oxomethyl]amino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[tert-butyl(naphthalen-1-ylcarbamoyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[tert-butyl(1-naphthylcarbamoyl)amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C22H25N3O3S MolecularWeight: 411.5172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)CN(C(=O)NC2=CC=CC3=CC=CC=C32)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)CN(C(=O)NC2=CC=CC3=CC=CC=C32)C(C)(C)C

InChI

InChI=1S/C22H25N3O3S/c1-5-28-20(26)18-14-29-19(23-18)13-25(22(2,3)4)21(27)24-17-12-8-10-15-9-6-7-11-16(15)17/h6-12,14H,5,13H2,1-4H3,(H,24,27)