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

Systemtic Name: 2-[[(3,4-dichlorophenyl)carbonyl-propyl-amino]methyl]-N-propyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(3,4-dichlorobenzoyl)-propyl-amino]methyl]-N-propyl-thiazole-4-carboxamide CAS Name: 2-[[[(3,4-dichlorophenyl)-oxomethyl]-propylamino]methyl]-N-propyl-4-thiazolecarboxamide IUPAC Name: 2-[[(3,4-dichlorobenzoyl)-propylamino]methyl]-N-propyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(3,4-dichlorobenzoyl)-propyl-amino]methyl]-N-propyl-thiazole-4-carboxamide Formula: C18H21Cl2N3O2S MolecularWeight: 414.34924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21Cl2N3O2S/c1-3-7-21-17(24)15-11-26-16(22-15)10-23(8-4-2)18(25)12-5-6-13(19)14(20)9-12/h5-6,9,11H,3-4,7-8,10H2,1-2H3,(H,21,24)