N-(6-azanylhexyl)-1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-5-ethyl-pyrazole-4-carboxamide

Systemtic Name: N-(6-azanylhexyl)-1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-5-ethyl-pyrazole-4-carboxamide Openeye Name: N-(6-aminohexyl)-1-[4-(4-chlorophenyl)thiazol-2-yl]-5-ethyl-pyrazole-4-carboxamide CAS Name: N-(6-aminohexyl)-1-[4-(4-chlorophenyl)-2-thiazolyl]-5-ethyl-4-pyrazolecarboxamide IUPAC Name: N-(6-aminohexyl)-1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-5-ethylpyrazole-4-carboxamide Traditional Name: N-(6-aminohexyl)-1-[4-(4-chlorophenyl)thiazol-2-yl]-5-ethyl-pyrazole-4-carboxamide Formula: C21H26ClN5OS MolecularWeight: 431.98204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=NC(=CS2)C3=CC=C(C=C3)Cl)C(=O)NCCCCCCN

Isomeric SMILES

CCC1=C(C=NN1C2=NC(=CS2)C3=CC=C(C=C3)Cl)C(=O)NCCCCCCN

InChI

InChI=1S/C21H26ClN5OS/c1-2-19-17(20(28)24-12-6-4-3-5-11-23)13-25-27(19)21-26-18(14-29-21)15-7-9-16(22)10-8-15/h7-10,13-14H,2-6,11-12,23H2,1H3,(H,24,28)