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

Systemtic Name: 3-[[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-propan-2-yl-amino]-N-pentyl-propanamide Openeye Name: 3-[[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-isopropyl-amino]-N-pentyl-propanamide CAS Name: 3-[[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-propan-2-ylamino]-N-pentylpropanamide IUPAC Name: 3-[[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-propan-2-ylamino]-N-pentylpropanamide Traditional Name: N-amyl-3-[[3-(4-fluorobenzyl)-1,2,4-thiadiazol-5-yl]-isopropyl-amino]propionamide Formula: C20H29FN4OS MolecularWeight: 392.533863

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H29FN4OS/c1-4-5-6-12-22-19(26)11-13-25(15(2)3)20-23-18(24-27-20)14-16-7-9-17(21)10-8-16/h7-10,15H,4-6,11-14H2,1-3H3,(H,22,26)