1-[6-(4-chlorophenyl)sulfanyl-5-nitro-pyrimidin-4-yl]benzimidazole

Systemtic Name: 1-[6-(4-chlorophenyl)sulfanyl-5-nitro-pyrimidin-4-yl]benzimidazole Openeye Name: 1-[6-(4-chlorophenyl)sulfanyl-5-nitro-pyrimidin-4-yl]benzimidazole CAS Name: 1-[6-[(4-chlorophenyl)thio]-5-nitro-4-pyrimidinyl]benzimidazole IUPAC Name: 1-[6-(4-chlorophenyl)sulfanyl-5-nitropyrimidin-4-yl]benzimidazole Traditional Name: 1-[6-[(4-chlorophenyl)thio]-5-nitro-pyrimidin-4-yl]benzimidazole Formula: C17H10ClN5O2S MolecularWeight: 383.8116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2C3=C(C(=NC=N3)SC4=CC=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=CN2C3=C(C(=NC=N3)SC4=CC=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H10ClN5O2S/c18-11-5-7-12(8-6-11)26-17-15(23(24)25)16(19-9-20-17)22-10-21-13-3-1-2-4-14(13)22/h1-10H