3-(1,3-benzodioxol-5-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]propionamide Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=O)CCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)CCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H21N3O3S/c1-3-12(4-2)16-19-20-17(24-16)18-15(21)8-6-11-5-7-13-14(9-11)23-10-22-13/h5,7,9,12H,3-4,6,8,10H2,1-2H3,(H,18,20,21)