2-(1-hexylbenzimidazol-2-yl)sulfanyl-N-(2-nitrophenyl)ethanamide

Systemtic Name: 2-(1-hexylbenzimidazol-2-yl)sulfanyl-N-(2-nitrophenyl)ethanamide Openeye Name: 2-(1-hexylbenzimidazol-2-yl)sulfanyl-N-(2-nitrophenyl)acetamide CAS Name: 2-[(1-hexyl-2-benzimidazolyl)thio]-N-(2-nitrophenyl)acetamide IUPAC Name: 2-(1-hexylbenzimidazol-2-yl)sulfanyl-N-(2-nitrophenyl)acetamide Traditional Name: 2-[(1-hexylbenzimidazol-2-yl)thio]-N-(2-nitrophenyl)acetamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2N=C1SCC(=O)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2N=C1SCC(=O)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O3S/c1-2-3-4-9-14-24-18-12-7-5-10-16(18)23-21(24)29-15-20(26)22-17-11-6-8-13-19(17)25(27)28/h5-8,10-13H,2-4,9,14-15H2,1H3,(H,22,26)