N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-(3-cyclopentylpropanoylamino)-3-methyl-pentanamide

Systemtic Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-(3-cyclopentylpropanoylamino)-3-methyl-pentanamide Openeye Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-(3-cyclopentylpropanoylamino)-3-methyl-pentanamide CAS Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-[(3-cyclopentyl-1-oxopropyl)amino]-3-methylpentanamide IUPAC Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-(3-cyclopentylpropanoylamino)-3-methylpentanamide Traditional Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-(3-cyclopentylpropanoylamino)-3-methyl-valeramide Formula: C22H29BrN4O2S MolecularWeight: 493.46026

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)Br)NC(=O)CCC3CCCC3

Isomeric SMILES

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)Br)NC(=O)CCC3CCCC3

InChI

InChI=1S/C22H29BrN4O2S/c1-3-14(2)19(24-18(28)13-8-15-6-4-5-7-15)20(29)25-22-27-26-21(30-22)16-9-11-17(23)12-10-16/h9-12,14-15,19H,3-8,13H2,1-2H3,(H,24,28)(H,25,27,29)