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

Systemtic Name: ethyl 2-[[[2,6-di(propan-2-yl)phenyl]carbamoyl-propan-2-yl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[(2,6-diisopropylphenyl)carbamoyl-isopropyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[[2,6-di(propan-2-yl)anilino]-oxomethyl]-propan-2-ylamino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[[2,6-di(propan-2-yl)phenyl]carbamoyl-propan-2-ylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(2,6-diisopropylphenyl)carbamoyl-isopropyl-amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C23H33N3O3S MolecularWeight: 431.59142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)CN(C(C)C)C(=O)NC2=C(C=CC=C2C(C)C)C(C)C

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)CN(C(C)C)C(=O)NC2=C(C=CC=C2C(C)C)C(C)C

InChI

InChI=1S/C23H33N3O3S/c1-8-29-22(27)19-13-30-20(24-19)12-26(16(6)7)23(28)25-21-17(14(2)3)10-9-11-18(21)15(4)5/h9-11,13-16H,8,12H2,1-7H3,(H,25,28)