(2S)-N-(4-acetamidophenyl)-2-[1-(4-fluorophenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-propanamide

Systemtic Name: (2S)-N-(4-acetamidophenyl)-2-[1-(4-fluorophenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-propanamide Openeye Name: (2S)-N-(4-acetamidophenyl)-2-[1-(4-fluorophenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-propanamide CAS Name: (2S)-N-(4-acetamidophenyl)-2-[[1-(4-fluorophenyl)-5-nitro-2-benzimidazolyl]thio]propanamide IUPAC Name: (2S)-N-(4-acetamidophenyl)-2-[1-(4-fluorophenyl)-5-nitrobenzimidazol-2-yl]sulfanylpropanamide Traditional Name: (2S)-N-(4-acetamidophenyl)-2-[[1-(4-fluorophenyl)-5-nitro-benzimidazol-2-yl]thio]propionamide Formula: C24H20FN5O4S MolecularWeight: 493.510103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)NC(=O)C)SC2=NC3=C(N2C4=CC=C(C=C4)F)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)NC(=O)C)SC2=NC3=C(N2C4=CC=C(C=C4)F)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H20FN5O4S/c1-14(23(32)27-18-7-5-17(6-8-18)26-15(2)31)35-24-28-21-13-20(30(33)34)11-12-22(21)29(24)19-9-3-16(25)4-10-19/h3-14H,1-2H3,(H,26,31)(H,27,32)/t14-/m0/s1