N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-2-(tert-butylcarbamoylamino)-3-phenyl-propanamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-2-(tert-butylcarbamoylamino)-3-phenyl-propanamide Openeye Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-2-(tert-butylcarbamoylamino)-3-phenyl-propanamide CAS Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-2-[[(tert-butylamino)-oxomethyl]amino]-3-phenylpropanamide IUPAC Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-2-(tert-butylcarbamoylamino)-3-phenylpropanamide Traditional Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-2-(tert-butylcarbamoylamino)-3-phenyl-propionamide Formula: C23H25N5O4S MolecularWeight: 467.5407

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC(CC1=CC=CC=C1)C(=O)NC2=NN=C(S2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)(C)NC(=O)NC(CC1=CC=CC=C1)C(=O)NC2=NN=C(S2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H25N5O4S/c1-23(2,3)26-21(30)24-16(11-14-7-5-4-6-8-14)19(29)25-22-28-27-20(33-22)15-9-10-17-18(12-15)32-13-31-17/h4-10,12,16H,11,13H2,1-3H3,(H2,24,26,30)(H,25,28,29)