2-(4-butylphenyl)-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]ethanamide

Systemtic Name: 2-(4-butylphenyl)-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]ethanamide Openeye Name: 2-(4-butylphenyl)-N-[5-(4-nitrophenyl)sulfonylthiazol-2-yl]acetamide CAS Name: 2-(4-butylphenyl)-N-[5-(4-nitrophenyl)sulfonyl-2-thiazolyl]acetamide IUPAC Name: 2-(4-butylphenyl)-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]acetamide Traditional Name: 2-(4-butylphenyl)-N-(5-nosylthiazol-2-yl)acetamide Formula: C21H21N3O5S2 MolecularWeight: 459.53854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CC(=O)NC2=NC=C(S2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)CC(=O)NC2=NC=C(S2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O5S2/c1-2-3-4-15-5-7-16(8-6-15)13-19(25)23-21-22-14-20(30-21)31(28,29)18-11-9-17(10-12-18)24(26)27/h5-12,14H,2-4,13H2,1H3,(H,22,23,25)