2-[[3-methylbutyl-[(5-methylthiophen-2-yl)methyl]amino]methyl]-N-(pyridin-2-ylmethyl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[3-methylbutyl-[(5-methylthiophen-2-yl)methyl]amino]methyl]-N-(pyridin-2-ylmethyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[[isopentyl-[(5-methyl-2-thienyl)methyl]amino]methyl]-N-(2-pyridylmethyl)thiazole-4-carboxamide CAS Name: 2-[[3-methylbutyl-[(5-methyl-2-thiophenyl)methyl]amino]methyl]-N-(2-pyridinylmethyl)-4-thiazolecarboxamide IUPAC Name: 2-[[3-methylbutyl-[(5-methylthiophen-2-yl)methyl]amino]methyl]-N-(pyridin-2-ylmethyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[[isoamyl-[(5-methyl-2-thienyl)methyl]amino]methyl]-N-(2-pyridylmethyl)thiazole-4-carboxamide Formula: C22H28N4OS2 MolecularWeight: 428.61392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(CCC(C)C)CC2=NC(=CS2)C(=O)NCC3=CC=CC=N3

Isomeric SMILES

CC1=CC=C(S1)CN(CCC(C)C)CC2=NC(=CS2)C(=O)NCC3=CC=CC=N3

InChI

InChI=1S/C22H28N4OS2/c1-16(2)9-11-26(13-19-8-7-17(3)29-19)14-21-25-20(15-28-21)22(27)24-12-18-6-4-5-10-23-18/h4-8,10,15-16H,9,11-14H2,1-3H3,(H,24,27)