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

Systemtic Name: 2-(4-tert-butylphenyl)sulfanyl-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]ethanamide Openeye Name: 2-(4-tert-butylphenyl)sulfanyl-N-[4-(4-nitrophenyl)thiazol-2-yl]acetamide CAS Name: 2-[(4-tert-butylphenyl)thio]-N-[4-(4-nitrophenyl)-2-thiazolyl]acetamide IUPAC Name: 2-(4-tert-butylphenyl)sulfanyl-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]acetamide Traditional Name: 2-[(4-tert-butylphenyl)thio]-N-[4-(4-nitrophenyl)thiazol-2-yl]acetamide Formula: C21H21N3O3S2 MolecularWeight: 427.53974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O3S2/c1-21(2,3)15-6-10-17(11-7-15)28-13-19(25)23-20-22-18(12-29-20)14-4-8-16(9-5-14)24(26)27/h4-12H,13H2,1-3H3,(H,22,23,25)