N-(5-undecyl-1,3,4-thiadiazol-2-yl)-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-(5-undecyl-1,3,4-thiadiazol-2-yl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-(5-undecyl-1,3,4-thiadiazol-2-yl)-1,3-benzodioxole-5-carboxamide CAS Name: N-(5-undecyl-1,3,4-thiadiazol-2-yl)-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(5-undecyl-1,3,4-thiadiazol-2-yl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-(5-undecyl-1,3,4-thiadiazol-2-yl)-piperonylamide Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=NN=C(S1)NC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCCCCCCCCCC1=NN=C(S1)NC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H29N3O3S/c1-2-3-4-5-6-7-8-9-10-11-19-23-24-21(28-19)22-20(25)16-12-13-17-18(14-16)27-15-26-17/h12-14H,2-11,15H2,1H3,(H,22,24,25)