1-[4-(1H-benzimidazol-2-yl)phenyl]-3-(2-chloranyl-5-nitro-phenyl)thiourea

Systemtic Name: 1-[4-(1H-benzimidazol-2-yl)phenyl]-3-(2-chloranyl-5-nitro-phenyl)thiourea Openeye Name: 1-[4-(1H-benzimidazol-2-yl)phenyl]-3-(2-chloro-5-nitro-phenyl)thiourea CAS Name: 1-[4-(1H-benzimidazol-2-yl)phenyl]-3-(2-chloro-5-nitrophenyl)thiourea IUPAC Name: 1-[4-(1H-benzimidazol-2-yl)phenyl]-3-(2-chloro-5-nitrophenyl)thiourea Traditional Name: 1-[4-(1H-benzimidazol-2-yl)phenyl]-3-(2-chloro-5-nitro-phenyl)thiourea Formula: C20H14ClN5O2S MolecularWeight: 423.87546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)NC(=S)NC4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)NC(=S)NC4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H14ClN5O2S/c21-15-10-9-14(26(27)28)11-18(15)25-20(29)22-13-7-5-12(6-8-13)19-23-16-3-1-2-4-17(16)24-19/h1-11H,(H,23,24)(H2,22,25,29)