N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide

Systemtic Name: N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide Openeye Name: N-[4-(4-acetamidophenyl)thiazol-2-yl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: N-[4-(4-acetamidophenyl)-2-thiazolyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide IUPAC Name: N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide Traditional Name: N-[4-(4-acetamidophenyl)thiazol-2-yl]-4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)butyramide Formula: C22H19N5O6S MolecularWeight: 481.48116

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C22H19N5O6S/c1-13(28)23-15-6-4-14(5-7-15)17-12-34-21(24-17)25-20(29)3-2-10-26-18-9-8-16(27(31)32)11-19(18)33-22(26)30/h4-9,11-12H,2-3,10H2,1H3,(H,23,28)(H,24,25,29)