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

Systemtic Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-2-(3-cyclopentylpropanoylamino)-3-methyl-pentanamide Openeye Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-2-(3-cyclopentylpropanoylamino)-3-methyl-pentanamide CAS Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-2-[(3-cyclopentyl-1-oxopropyl)amino]-3-methylpentanamide IUPAC Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-2-(3-cyclopentylpropanoylamino)-3-methylpentanamide Traditional Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-2-(3-cyclopentylpropanoylamino)-3-methyl-valeramide Formula: C23H30N4O4S MolecularWeight: 458.5737

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC3=C(C=C2)OCO3)NC(=O)CCC4CCCC4

Isomeric SMILES

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC3=C(C=C2)OCO3)NC(=O)CCC4CCCC4

InChI

InChI=1S/C23H30N4O4S/c1-3-14(2)20(24-19(28)11-8-15-6-4-5-7-15)21(29)25-23-27-26-22(32-23)16-9-10-17-18(12-16)31-13-30-17/h9-10,12,14-15,20H,3-8,11,13H2,1-2H3,(H,24,28)(H,25,27,29)