N-(4-tert-butylphenyl)-2-[2-(5-nitrothiophen-2-yl)benzimidazol-1-yl]ethanamide

Systemtic Name: N-(4-tert-butylphenyl)-2-[2-(5-nitrothiophen-2-yl)benzimidazol-1-yl]ethanamide Openeye Name: N-(4-tert-butylphenyl)-2-[2-(5-nitro-2-thienyl)benzimidazol-1-yl]acetamide CAS Name: N-(4-tert-butylphenyl)-2-[2-(5-nitro-2-thiophenyl)-1-benzimidazolyl]acetamide IUPAC Name: N-(4-tert-butylphenyl)-2-[2-(5-nitrothiophen-2-yl)benzimidazol-1-yl]acetamide Traditional Name: N-(4-tert-butylphenyl)-2-[2-(5-nitro-2-thienyl)benzimidazol-1-yl]acetamide Formula: C23H22N4O3S MolecularWeight: 434.51078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)CN2C3=CC=CC=C3N=C2C4=CC=C(S4)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)CN2C3=CC=CC=C3N=C2C4=CC=C(S4)[N+](=O)[O-]

InChI

InChI=1S/C23H22N4O3S/c1-23(2,3)15-8-10-16(11-9-15)24-20(28)14-26-18-7-5-4-6-17(18)25-22(26)19-12-13-21(31-19)27(29)30/h4-13H,14H2,1-3H3,(H,24,28)