S-(6-nitro-1H-benzimidazol-2-yl) 4-chloranylbenzenecarbothioate

Systemtic Name: S-(6-nitro-1H-benzimidazol-2-yl) 4-chloranylbenzenecarbothioate Openeye Name: S-(6-nitro-1H-benzimidazol-2-yl) 4-chlorobenzenecarbothioate CAS Name: 4-chlorobenzenecarbothioic acid S-(6-nitro-1H-benzimidazol-2-yl) ester IUPAC Name: S-(6-nitro-1H-benzimidazol-2-yl) 4-chlorobenzenecarbothioate Traditional Name: 4-chlorothiobenzoic acid S-(6-nitro-1H-benzimidazol-2-yl) ester Formula: C14H8ClN3O3S MolecularWeight: 333.74962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)SC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)SC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H8ClN3O3S/c15-9-3-1-8(2-4-9)13(19)22-14-16-11-6-5-10(18(20)21)7-12(11)17-14/h1-7H,(H,16,17)