3-[[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-(2-methoxyethyl)amino]-N-hexyl-propanamide

Systemtic Name: 3-[[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-(2-methoxyethyl)amino]-N-hexyl-propanamide Openeye Name: 3-[[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-(2-methoxyethyl)amino]-N-hexyl-propanamide CAS Name: 3-[[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-(2-methoxyethyl)amino]-N-hexylpropanamide IUPAC Name: 3-[[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-(2-methoxyethyl)amino]-N-hexylpropanamide Traditional Name: 3-[[3-(4-fluorobenzyl)-1,2,4-thiadiazol-5-yl]-(2-methoxyethyl)amino]-N-hexyl-propionamide Formula: C21H31FN4O2S MolecularWeight: 422.559843

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)CCN(CCOC)C1=NC(=NS1)CC2=CC=C(C=C2)F

Isomeric SMILES

CCCCCCNC(=O)CCN(CCOC)C1=NC(=NS1)CC2=CC=C(C=C2)F

InChI

InChI=1S/C21H31FN4O2S/c1-3-4-5-6-12-23-20(27)11-13-26(14-15-28-2)21-24-19(25-29-21)16-17-7-9-18(22)10-8-17/h7-10H,3-6,11-16H2,1-2H3,(H,23,27)