S-(1H-benzimidazol-2-yl) N-(2-nitrophenyl)carbamothioate

Systemtic Name: S-(1H-benzimidazol-2-yl) N-(2-nitrophenyl)carbamothioate Openeye Name: S-(1H-benzimidazol-2-yl) N-(2-nitrophenyl)carbamothioate CAS Name: N-(2-nitrophenyl)carbamothioic acid S-(1H-benzimidazol-2-yl) ester IUPAC Name: S-(1H-benzimidazol-2-yl) N-(2-nitrophenyl)carbamothioate Traditional Name: N-(2-nitrophenyl)thiocarbamic acid S-(1H-benzimidazol-2-yl) ester Formula: C14H10N4O3S MolecularWeight: 314.3192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SC(=O)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SC(=O)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C14H10N4O3S/c19-14(17-11-7-3-4-8-12(11)18(20)21)22-13-15-9-5-1-2-6-10(9)16-13/h1-8H,(H,15,16)(H,17,19)