ethyl 2-[[[2,6-di(propan-2-yl)phenyl]carbamoyl-pentyl-amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[[[2,6-di(propan-2-yl)phenyl]carbamoyl-pentyl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[(2,6-diisopropylphenyl)carbamoyl-pentyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[[2,6-di(propan-2-yl)anilino]-oxomethyl]-pentylamino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[[2,6-di(propan-2-yl)phenyl]carbamoyl-pentylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[amyl-[(2,6-diisopropylphenyl)carbamoyl]amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C25H37N3O3S MolecularWeight: 459.64458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=NC(=CS1)C(=O)OCC)C(=O)NC2=C(C=CC=C2C(C)C)C(C)C

Isomeric SMILES

CCCCCN(CC1=NC(=CS1)C(=O)OCC)C(=O)NC2=C(C=CC=C2C(C)C)C(C)C

InChI

InChI=1S/C25H37N3O3S/c1-7-9-10-14-28(15-22-26-21(16-32-22)24(29)31-8-2)25(30)27-23-19(17(3)4)12-11-13-20(23)18(5)6/h11-13,16-18H,7-10,14-15H2,1-6H3,(H,27,30)