4-methyl-2-(3-methylbutylamino)-N-(pyridin-3-ylmethyl)-1,3-thiazole-5-carboxamide

Systemtic Name: 4-methyl-2-(3-methylbutylamino)-N-(pyridin-3-ylmethyl)-1,3-thiazole-5-carboxamide Openeye Name: 2-(isopentylamino)-4-methyl-N-(3-pyridylmethyl)thiazole-5-carboxamide CAS Name: 4-methyl-2-(3-methylbutylamino)-N-(3-pyridinylmethyl)-5-thiazolecarboxamide IUPAC Name: 4-methyl-2-(3-methylbutylamino)-N-(pyridin-3-ylmethyl)-1,3-thiazole-5-carboxamide Traditional Name: 2-(isoamylamino)-4-methyl-N-(3-pyridylmethyl)thiazole-5-carboxamide Formula: C16H22N4OS MolecularWeight: 318.43708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NCCC(C)C)C(=O)NCC2=CN=CC=C2

Isomeric SMILES

CC1=C(SC(=N1)NCCC(C)C)C(=O)NCC2=CN=CC=C2

InChI

InChI=1S/C16H22N4OS/c1-11(2)6-8-18-16-20-12(3)14(22-16)15(21)19-10-13-5-4-7-17-9-13/h4-5,7,9,11H,6,8,10H2,1-3H3,(H,18,20)(H,19,21)