3-[1-(4-chlorophenyl)propylsulfanyl]-5-[(6-methylpyridin-3-yl)amino]-1,2-thiazole-4-carboxamide

Systemtic Name: 3-[1-(4-chlorophenyl)propylsulfanyl]-5-[(6-methylpyridin-3-yl)amino]-1,2-thiazole-4-carboxamide Openeye Name: 3-[1-(4-chlorophenyl)propylsulfanyl]-5-[(6-methyl-3-pyridyl)amino]isothiazole-4-carboxamide CAS Name: 3-[1-(4-chlorophenyl)propylthio]-5-[(6-methyl-3-pyridinyl)amino]-4-isothiazolecarboxamide IUPAC Name: 3-[1-(4-chlorophenyl)propylsulfanyl]-5-[(6-methylpyridin-3-yl)amino]-1,2-thiazole-4-carboxamide Traditional Name: 3-[1-(4-chlorophenyl)propylthio]-5-[(6-methyl-3-pyridyl)amino]isothiazole-4-carboxamide Formula: C19H19ClN4OS2 MolecularWeight: 418.96336

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)Cl)SC2=NSC(=C2C(=O)N)NC3=CN=C(C=C3)C

Isomeric SMILES

CCC(C1=CC=C(C=C1)Cl)SC2=NSC(=C2C(=O)N)NC3=CN=C(C=C3)C

InChI

InChI=1S/C19H19ClN4OS2/c1-3-15(12-5-7-13(20)8-6-12)26-19-16(17(21)25)18(27-24-19)23-14-9-4-11(2)22-10-14/h4-10,15,23H,3H2,1-2H3,(H2,21,25)