1-[4-(6-methyl-1H-benzimidazol-2-yl)phenyl]-3-(4-nitrophenyl)urea

Systemtic Name: 1-[4-(6-methyl-1H-benzimidazol-2-yl)phenyl]-3-(4-nitrophenyl)urea Openeye Name: 1-[4-(6-methyl-1H-benzimidazol-2-yl)phenyl]-3-(4-nitrophenyl)urea CAS Name: 1-[4-(6-methyl-1H-benzimidazol-2-yl)phenyl]-3-(4-nitrophenyl)urea IUPAC Name: 1-[4-(6-methyl-1H-benzimidazol-2-yl)phenyl]-3-(4-nitrophenyl)urea Traditional Name: 1-[4-(6-methyl-1H-benzimidazol-2-yl)phenyl]-3-(4-nitrophenyl)urea Formula: C21H17N5O3 MolecularWeight: 387.39138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)C3=CC=C(C=C3)NC(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)C3=CC=C(C=C3)NC(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H17N5O3/c1-13-2-11-18-19(12-13)25-20(24-18)14-3-5-15(6-4-14)22-21(27)23-16-7-9-17(10-8-16)26(28)29/h2-12H,1H3,(H,24,25)(H2,22,23,27)