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

Systemtic Name: N-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide Openeye Name: N-[4-(1H-indol-3-yl)thiazol-2-yl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: N-[4-(1H-indol-3-yl)-2-thiazolyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide IUPAC Name: N-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide Traditional Name: N-[4-(1H-indol-3-yl)thiazol-2-yl]-4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)butyramide Formula: C22H17N5O5S MolecularWeight: 463.46588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)C3=CSC(=N3)NC(=O)CCCN4C5=C(C=C(C=C5)[N+](=O)[O-])OC4=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C3=CSC(=N3)NC(=O)CCCN4C5=C(C=C(C=C5)[N+](=O)[O-])OC4=O

InChI

InChI=1S/C22H17N5O5S/c28-20(6-3-9-26-18-8-7-13(27(30)31)10-19(18)32-22(26)29)25-21-24-17(12-33-21)15-11-23-16-5-2-1-4-14(15)16/h1-2,4-5,7-8,10-12,23H,3,6,9H2,(H,24,25,28)