3-[3-(1H-benzimidazol-2-yl)propyl]-1-methyl-1-[1-(3-nitrophenyl)ethyl]urea

Systemtic Name: 3-[3-(1H-benzimidazol-2-yl)propyl]-1-methyl-1-[1-(3-nitrophenyl)ethyl]urea Openeye Name: 3-[3-(1H-benzimidazol-2-yl)propyl]-1-methyl-1-[1-(3-nitrophenyl)ethyl]urea CAS Name: 3-[3-(1H-benzimidazol-2-yl)propyl]-1-methyl-1-[1-(3-nitrophenyl)ethyl]urea IUPAC Name: 3-[3-(1H-benzimidazol-2-yl)propyl]-1-methyl-1-[1-(3-nitrophenyl)ethyl]urea Traditional Name: 3-[3-(1H-benzimidazol-2-yl)propyl]-1-methyl-1-[1-(3-nitrophenyl)ethyl]urea Formula: C20H23N5O3 MolecularWeight: 381.42832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)C(=O)NCCCC2=NC3=CC=CC=C3N2

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)C(=O)NCCCC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C20H23N5O3/c1-14(15-7-5-8-16(13-15)25(27)28)24(2)20(26)21-12-6-11-19-22-17-9-3-4-10-18(17)23-19/h3-5,7-10,13-14H,6,11-12H2,1-2H3,(H,21,26)(H,22,23)