1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-[[4-(imidazol-1-ylmethyl)phenyl]methyl]urea

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-[[4-(imidazol-1-ylmethyl)phenyl]methyl]urea Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-[[4-(imidazol-1-ylmethyl)phenyl]methyl]urea CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-[[4-(1-imidazolylmethyl)phenyl]methyl]urea IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-[[4-(imidazol-1-ylmethyl)phenyl]methyl]urea Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-[4-(imidazol-1-ylmethyl)benzyl]urea Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)CNC(=O)NCC3=CC=C(C=C3)CN4C=CN=C4

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)CNC(=O)NCC3=CC=C(C=C3)CN4C=CN=C4

InChI

InChI=1S/C21H22N4O3/c26-21(24-12-18-14-27-19-3-1-2-4-20(19)28-18)23-11-16-5-7-17(8-6-16)13-25-10-9-22-15-25/h1-10,15,18H,11-14H2,(H2,23,24,26)