1-(1,3-benzodioxol-5-ylmethyl)-3-[[4-(imidazol-1-ylmethyl)phenyl]methyl]urea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[4-(imidazol-1-ylmethyl)phenyl]methyl]urea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[4-(imidazol-1-ylmethyl)phenyl]methyl]urea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[4-(1-imidazolylmethyl)phenyl]methyl]urea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[4-(imidazol-1-ylmethyl)phenyl]methyl]urea Traditional Name: 1-[4-(imidazol-1-ylmethyl)benzyl]-3-piperonyl-urea Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)NCC3=CC=C(C=C3)CN4C=CN=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)NCC3=CC=C(C=C3)CN4C=CN=C4

InChI

InChI=1S/C20H20N4O3/c25-20(23-11-17-5-6-18-19(9-17)27-14-26-18)22-10-15-1-3-16(4-2-15)12-24-8-7-21-13-24/h1-9,13H,10-12,14H2,(H2,22,23,25)