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

Systemtic Name: 2-[[(3-chloranyl-4-methyl-phenyl)carbamoyl-propyl-amino]methyl]-N-propyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(3-chloro-4-methyl-phenyl)carbamoyl-propyl-amino]methyl]-N-propyl-thiazole-4-carboxamide CAS Name: 2-[[[(3-chloro-4-methylanilino)-oxomethyl]-propylamino]methyl]-N-propyl-4-thiazolecarboxamide IUPAC Name: 2-[[(3-chloro-4-methylphenyl)carbamoyl-propylamino]methyl]-N-propyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(3-chloro-4-methyl-phenyl)carbamoyl-propyl-amino]methyl]-N-propyl-thiazole-4-carboxamide Formula: C19H25ClN4O2S MolecularWeight: 408.9454

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C19H25ClN4O2S/c1-4-8-21-18(25)16-12-27-17(23-16)11-24(9-5-2)19(26)22-14-7-6-13(3)15(20)10-14/h6-7,10,12H,4-5,8-9,11H2,1-3H3,(H,21,25)(H,22,26)