2-[[2-(4-chloranylphenoxy)ethanoyl-propyl-amino]methyl]-N-propyl-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[2-(4-chloranylphenoxy)ethanoyl-propyl-amino]methyl]-N-propyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[[2-(4-chlorophenoxy)acetyl]-propyl-amino]methyl]-N-propyl-thiazole-4-carboxamide CAS Name: 2-[[[2-(4-chlorophenoxy)-1-oxoethyl]-propylamino]methyl]-N-propyl-4-thiazolecarboxamide IUPAC Name: 2-[[[2-(4-chlorophenoxy)acetyl]-propylamino]methyl]-N-propyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[[2-(4-chlorophenoxy)acetyl]-propyl-amino]methyl]-N-propyl-thiazole-4-carboxamide Formula: C19H24ClN3O3S MolecularWeight: 409.93016

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CSC(=N1)CN(CCC)C(=O)COC2=CC=C(C=C2)Cl

Isomeric SMILES

CCCNC(=O)C1=CSC(=N1)CN(CCC)C(=O)COC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H24ClN3O3S/c1-3-9-21-19(25)16-13-27-17(22-16)11-23(10-4-2)18(24)12-26-15-7-5-14(20)6-8-15/h5-8,13H,3-4,9-12H2,1-2H3,(H,21,25)