2-[[phenylcarbamoyl(propan-2-yl)amino]methyl]-N-(2-pyridin-2-ylethyl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[phenylcarbamoyl(propan-2-yl)amino]methyl]-N-(2-pyridin-2-ylethyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[[isopropyl(phenylcarbamoyl)amino]methyl]-N-[2-(2-pyridyl)ethyl]thiazole-4-carboxamide CAS Name: 2-[[[anilino(oxo)methyl]-propan-2-ylamino]methyl]-N-[2-(2-pyridinyl)ethyl]-4-thiazolecarboxamide IUPAC Name: 2-[[phenylcarbamoyl(propan-2-yl)amino]methyl]-N-(2-pyridin-2-ylethyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[[isopropyl(phenylcarbamoyl)amino]methyl]-N-[2-(2-pyridyl)ethyl]thiazole-4-carboxamide Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=NC(=CS1)C(=O)NCCC2=CC=CC=N2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)N(CC1=NC(=CS1)C(=O)NCCC2=CC=CC=N2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H25N5O2S/c1-16(2)27(22(29)25-18-9-4-3-5-10-18)14-20-26-19(15-30-20)21(28)24-13-11-17-8-6-7-12-23-17/h3-10,12,15-16H,11,13-14H2,1-2H3,(H,24,28)(H,25,29)