1-[3H-benzimidazol-5-yl(phenyl)methyl]-3-[3-(2-oxidanylideneazepan-1-yl)propyl]urea

Systemtic Name: 1-[3H-benzimidazol-5-yl(phenyl)methyl]-3-[3-(2-oxidanylideneazepan-1-yl)propyl]urea Openeye Name: 1-[3H-benzimidazol-5-yl(phenyl)methyl]-3-[3-(2-oxoazepan-1-yl)propyl]urea CAS Name: 1-[3H-benzimidazol-5-yl(phenyl)methyl]-3-[3-(2-oxo-1-azepanyl)propyl]urea IUPAC Name: 1-[3H-benzimidazol-5-yl(phenyl)methyl]-3-[3-(2-oxoazepan-1-yl)propyl]urea Traditional Name: 1-[3H-benzimidazol-5-yl(phenyl)methyl]-3-[3-(2-ketoazepan-1-yl)propyl]urea Formula: C24H29N5O2 MolecularWeight: 419.51936

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCNC(=O)NC(C2=CC=CC=C2)C3=CC4=C(C=C3)N=CN4

Isomeric SMILES

C1CCC(=O)N(CC1)CCCNC(=O)NC(C2=CC=CC=C2)C3=CC4=C(C=C3)N=CN4

InChI

InChI=1S/C24H29N5O2/c30-22-10-5-2-6-14-29(22)15-7-13-25-24(31)28-23(18-8-3-1-4-9-18)19-11-12-20-21(16-19)27-17-26-20/h1,3-4,8-9,11-12,16-17,23H,2,5-7,10,13-15H2,(H,26,27)(H2,25,28,31)