2-[3-(1,3-benzodioxol-5-ylmethylamino)propyl-(3-imidazol-1-yl-1,2,4-thiadiazol-5-yl)amino]ethanamide

Systemtic Name: 2-[3-(1,3-benzodioxol-5-ylmethylamino)propyl-(3-imidazol-1-yl-1,2,4-thiadiazol-5-yl)amino]ethanamide Openeye Name: 2-[3-(1,3-benzodioxol-5-ylmethylamino)propyl-(3-imidazol-1-yl-1,2,4-thiadiazol-5-yl)amino]acetamide CAS Name: 2-[3-(1,3-benzodioxol-5-ylmethylamino)propyl-[3-(1-imidazolyl)-1,2,4-thiadiazol-5-yl]amino]acetamide IUPAC Name: 2-[3-(1,3-benzodioxol-5-ylmethylamino)propyl-(3-imidazol-1-yl-1,2,4-thiadiazol-5-yl)amino]acetamide Traditional Name: 2-[(3-imidazol-1-yl-1,2,4-thiadiazol-5-yl)-[3-(piperonylamino)propyl]amino]acetamide Formula: C18H21N7O3S MolecularWeight: 415.46944

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNCCCN(CC(=O)N)C3=NC(=NS3)N4C=CN=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNCCCN(CC(=O)N)C3=NC(=NS3)N4C=CN=C4

InChI

InChI=1S/C18H21N7O3S/c19-16(26)10-24(18-22-17(23-29-18)25-7-5-21-11-25)6-1-4-20-9-13-2-3-14-15(8-13)28-12-27-14/h2-3,5,7-8,11,20H,1,4,6,9-10,12H2,(H2,19,26)