N-(2-methylpropyl)-2-[[2-methylpropyl-[(phenylmethyl)carbamoyl]amino]methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(2-methylpropyl)-2-[[2-methylpropyl-[(phenylmethyl)carbamoyl]amino]methyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[[benzylcarbamoyl(isobutyl)amino]methyl]-N-isobutyl-thiazole-4-carboxamide CAS Name: N-(2-methylpropyl)-2-[[2-methylpropyl-[oxo-[(phenylmethyl)amino]methyl]amino]methyl]-4-thiazolecarboxamide IUPAC Name: 2-[[benzylcarbamoyl(2-methylpropyl)amino]methyl]-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[[benzylcarbamoyl(isobutyl)amino]methyl]-N-isobutyl-thiazole-4-carboxamide Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CSC(=N1)CN(CC(C)C)C(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC(C)CNC(=O)C1=CSC(=N1)CN(CC(C)C)C(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C21H30N4O2S/c1-15(2)10-22-20(26)18-14-28-19(24-18)13-25(12-16(3)4)21(27)23-11-17-8-6-5-7-9-17/h5-9,14-16H,10-13H2,1-4H3,(H,22,26)(H,23,27)