3-[2-methylpropyl-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]amino]-N-pentyl-propanamide

Systemtic Name: 3-[2-methylpropyl-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]amino]-N-pentyl-propanamide Openeye Name: 3-[(3-benzyl-1,2,4-thiadiazol-5-yl)-isobutyl-amino]-N-pentyl-propanamide CAS Name: 3-[2-methylpropyl-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]amino]-N-pentylpropanamide IUPAC Name: 3-[(3-benzyl-1,2,4-thiadiazol-5-yl)-(2-methylpropyl)amino]-N-pentylpropanamide Traditional Name: N-amyl-3-[(3-benzyl-1,2,4-thiadiazol-5-yl)-isobutyl-amino]propionamide Formula: C21H32N4OS MolecularWeight: 388.56998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32N4OS/c1-4-5-9-13-22-20(26)12-14-25(16-17(2)3)21-23-19(24-27-21)15-18-10-7-6-8-11-18/h6-8,10-11,17H,4-5,9,12-16H2,1-3H3,(H,22,26)