1-[(2-chlorophenyl)methyl]-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)pyrazole-4-carboxamide

Systemtic Name: 1-[(2-chlorophenyl)methyl]-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)pyrazole-4-carboxamide Openeye Name: 1-[(2-chlorophenyl)methyl]-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide CAS Name: 1-[(2-chlorophenyl)methyl]-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-4-pyrazolecarboxamide IUPAC Name: 1-[(2-chlorophenyl)methyl]-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)pyrazole-4-carboxamide Traditional Name: 1-(2-chlorobenzyl)-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide Formula: C18H20ClN5OS MolecularWeight: 389.9023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=O)C2=CN(N=C2)CC3=CC=CC=C3Cl

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)C2=CN(N=C2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C18H20ClN5OS/c1-3-12(4-2)17-22-23-18(26-17)21-16(25)14-9-20-24(11-14)10-13-7-5-6-8-15(13)19/h5-9,11-12H,3-4,10H2,1-2H3,(H,21,23,25)