N-butyl-2-[[2-[[phenylcarbonyl(propyl)amino]methyl]pyrrol-1-yl]methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-butyl-2-[[2-[[phenylcarbonyl(propyl)amino]methyl]pyrrol-1-yl]methyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[[2-[[benzoyl(propyl)amino]methyl]pyrrol-1-yl]methyl]-N-butyl-thiazole-4-carboxamide CAS Name: 2-[[2-[[benzoyl(propyl)amino]methyl]-1-pyrrolyl]methyl]-N-butyl-4-thiazolecarboxamide IUPAC Name: 2-[[2-[[benzoyl(propyl)amino]methyl]pyrrol-1-yl]methyl]-N-butyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[2-[[benzoyl(propyl)amino]methyl]pyrrol-1-yl]methyl]-N-butyl-thiazole-4-carboxamide Formula: C24H30N4O2S MolecularWeight: 438.5856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CSC(=N1)CN2C=CC=C2CN(CCC)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)C1=CSC(=N1)CN2C=CC=C2CN(CCC)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H30N4O2S/c1-3-5-13-25-23(29)21-18-31-22(26-21)17-27-15-9-12-20(27)16-28(14-4-2)24(30)19-10-7-6-8-11-19/h6-12,15,18H,3-5,13-14,16-17H2,1-2H3,(H,25,29)