2-[[(2,6-dimethylphenyl)carbamoyl-propan-2-yl-amino]methyl]-N-(3-methoxypropyl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[(2,6-dimethylphenyl)carbamoyl-propan-2-yl-amino]methyl]-N-(3-methoxypropyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(2,6-dimethylphenyl)carbamoyl-isopropyl-amino]methyl]-N-(3-methoxypropyl)thiazole-4-carboxamide CAS Name: 2-[[[(2,6-dimethylanilino)-oxomethyl]-propan-2-ylamino]methyl]-N-(3-methoxypropyl)-4-thiazolecarboxamide IUPAC Name: 2-[[(2,6-dimethylphenyl)carbamoyl-propan-2-ylamino]methyl]-N-(3-methoxypropyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(2,6-dimethylphenyl)carbamoyl-isopropyl-amino]methyl]-N-(3-methoxypropyl)thiazole-4-carboxamide Formula: C21H30N4O3S MolecularWeight: 418.5529

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)N(CC2=NC(=CS2)C(=O)NCCCOC)C(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)N(CC2=NC(=CS2)C(=O)NCCCOC)C(C)C

InChI

InChI=1S/C21H30N4O3S/c1-14(2)25(21(27)24-19-15(3)8-6-9-16(19)4)12-18-23-17(13-29-18)20(26)22-10-7-11-28-5/h6,8-9,13-14H,7,10-12H2,1-5H3,(H,22,26)(H,24,27)