N-[3-[2-(2,4-dimethyl-6-nitro-phenoxy)ethanoylamino]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[2-(2,4-dimethyl-6-nitro-phenoxy)ethanoylamino]phenyl]thiophene-2-carboxamide Openeye Name: N-[3-[[2-(2,4-dimethyl-6-nitro-phenoxy)acetyl]amino]phenyl]thiophene-2-carboxamide CAS Name: N-[3-[[2-(2,4-dimethyl-6-nitrophenoxy)-1-oxoethyl]amino]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[[2-(2,4-dimethyl-6-nitrophenoxy)acetyl]amino]phenyl]thiophene-2-carboxamide Traditional Name: N-[3-[[2-(2,4-dimethyl-6-nitro-phenoxy)acetyl]amino]phenyl]thiophene-2-carboxamide Formula: C21H19N3O5S MolecularWeight: 425.45766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)[N+](=O)[O-])OCC(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)[N+](=O)[O-])OCC(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=CS3)C

InChI

InChI=1S/C21H19N3O5S/c1-13-9-14(2)20(17(10-13)24(27)28)29-12-19(25)22-15-5-3-6-16(11-15)23-21(26)18-7-4-8-30-18/h3-11H,12H2,1-2H3,(H,22,25)(H,23,26)