2-[[(4-propan-2-ylphenyl)carbamoyl-propyl-amino]methyl]-N-propyl-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[(4-propan-2-ylphenyl)carbamoyl-propyl-amino]methyl]-N-propyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(4-isopropylphenyl)carbamoyl-propyl-amino]methyl]-N-propyl-thiazole-4-carboxamide CAS Name: 2-[[[oxo-(4-propan-2-ylanilino)methyl]-propylamino]methyl]-N-propyl-4-thiazolecarboxamide IUPAC Name: 2-[[(4-propan-2-ylphenyl)carbamoyl-propylamino]methyl]-N-propyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[p-cumenylcarbamoyl(propyl)amino]methyl]-N-propyl-thiazole-4-carboxamide Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CSC(=N1)CN(CCC)C(=O)NC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CCCNC(=O)C1=CSC(=N1)CN(CCC)C(=O)NC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C21H30N4O2S/c1-5-11-22-20(26)18-14-28-19(24-18)13-25(12-6-2)21(27)23-17-9-7-16(8-10-17)15(3)4/h7-10,14-15H,5-6,11-13H2,1-4H3,(H,22,26)(H,23,27)