3-[butan-2-yl-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-N-(pyridin-4-ylmethyl)propanamide

Systemtic Name: 3-[butan-2-yl-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-N-(pyridin-4-ylmethyl)propanamide Openeye Name: 3-[[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-sec-butyl-amino]-N-(4-pyridylmethyl)propanamide CAS Name: 3-[butan-2-yl-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-N-(pyridin-4-ylmethyl)propanamide IUPAC Name: 3-[butan-2-yl-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-N-(pyridin-4-ylmethyl)propanamide Traditional Name: 3-[[3-(4-fluorobenzyl)-1,2,4-thiadiazol-5-yl]-sec-butyl-amino]-N-(4-pyridylmethyl)propionamide Formula: C22H26FN5OS MolecularWeight: 427.538143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CCC(=O)NCC1=CC=NC=C1)C2=NC(=NS2)CC3=CC=C(C=C3)F

Isomeric SMILES

CCC(C)N(CCC(=O)NCC1=CC=NC=C1)C2=NC(=NS2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C22H26FN5OS/c1-3-16(2)28(13-10-21(29)25-15-18-8-11-24-12-9-18)22-26-20(27-30-22)14-17-4-6-19(23)7-5-17/h4-9,11-12,16H,3,10,13-15H2,1-2H3,(H,25,29)