1-(4-aminophenyl)-3-[[3-(4-chlorophenyl)-5-methyl-1-benzofuran-2-yl]methyl]-1-heptyl-urea

Systemtic Name: 1-(4-aminophenyl)-3-[[3-(4-chlorophenyl)-5-methyl-1-benzofuran-2-yl]methyl]-1-heptyl-urea Openeye Name: 1-(4-aminophenyl)-3-[[3-(4-chlorophenyl)-5-methyl-benzofuran-2-yl]methyl]-1-heptyl-urea CAS Name: 1-(4-aminophenyl)-3-[[3-(4-chlorophenyl)-5-methyl-2-benzofuranyl]methyl]-1-heptylurea IUPAC Name: 1-(4-aminophenyl)-3-[[3-(4-chlorophenyl)-5-methyl-1-benzofuran-2-yl]methyl]-1-heptylurea Traditional Name: 1-(4-aminophenyl)-3-[[3-(4-chlorophenyl)-5-methyl-benzofuran-2-yl]methyl]-1-heptyl-urea Formula: C30H34ClN3O2 MolecularWeight: 504.06286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(C1=CC=C(C=C1)N)C(=O)NCC2=C(C3=C(O2)C=CC(=C3)C)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCCCCCCN(C1=CC=C(C=C1)N)C(=O)NCC2=C(C3=C(O2)C=CC(=C3)C)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C30H34ClN3O2/c1-3-4-5-6-7-18-34(25-15-13-24(32)14-16-25)30(35)33-20-28-29(22-9-11-23(31)12-10-22)26-19-21(2)8-17-27(26)36-28/h8-17,19H,3-7,18,20,32H2,1-2H3,(H,33,35)