N-[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]-2-(3-nitrophenoxy)ethanamide

Systemtic Name: N-[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]-2-(3-nitrophenoxy)ethanamide Openeye Name: N-[4-[4-(3-acetamidopropyl)phenyl]thiazol-2-yl]-2-(3-nitrophenoxy)acetamide CAS Name: N-[4-[4-(3-acetamidopropyl)phenyl]-2-thiazolyl]-2-(3-nitrophenoxy)acetamide IUPAC Name: N-[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]-2-(3-nitrophenoxy)acetamide Traditional Name: N-[4-[4-(3-acetamidopropyl)phenyl]thiazol-2-yl]-2-(3-nitrophenoxy)acetamide Formula: C22H22N4O5S MolecularWeight: 454.49888

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)COC3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NCCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)COC3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O5S/c1-15(27)23-11-3-4-16-7-9-17(10-8-16)20-14-32-22(24-20)25-21(28)13-31-19-6-2-5-18(12-19)26(29)30/h2,5-10,12,14H,3-4,11,13H2,1H3,(H,23,27)(H,24,25,28)