N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(1-methylpyrazol-4-yl)-1,3-thiazole-4-carboxamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(1-methylpyrazol-4-yl)-1,3-thiazole-4-carboxamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(1-methylpyrazol-4-yl)thiazole-4-carboxamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-2-(1-methyl-4-pyrazolyl)-4-thiazolecarboxamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(1-methylpyrazol-4-yl)-1,3-thiazole-4-carboxamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-2-(1-methylpyrazol-4-yl)thiazole-4-carboxamide Formula: C18H17N5OS2 MolecularWeight: 383.49048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=NC(=CS2)C(=O)NCCSCC3=CC=CC=C3C#N

Isomeric SMILES

CN1C=C(C=N1)C2=NC(=CS2)C(=O)NCCSCC3=CC=CC=C3C#N

InChI

InChI=1S/C18H17N5OS2/c1-23-10-15(9-21-23)18-22-16(12-26-18)17(24)20-6-7-25-11-14-5-3-2-4-13(14)8-19/h2-5,9-10,12H,6-7,11H2,1H3,(H,20,24)