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

Systemtic Name: N-[4-[2-(2-bromanyl-4,6-dimethyl-phenoxy)ethanoylamino]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[[2-(2-bromo-4,6-dimethyl-phenoxy)acetyl]amino]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[2-(2-bromo-4,6-dimethylphenoxy)-1-oxoethyl]amino]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[[2-(2-bromo-4,6-dimethylphenoxy)acetyl]amino]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[[2-(2-bromo-4,6-dimethyl-phenoxy)acetyl]amino]phenyl]thiophene-2-carboxamide Formula: C21H19BrN2O3S MolecularWeight: 459.35616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CS3)C

InChI

InChI=1S/C21H19BrN2O3S/c1-13-10-14(2)20(17(22)11-13)27-12-19(25)23-15-5-7-16(8-6-15)24-21(26)18-4-3-9-28-18/h3-11H,12H2,1-2H3,(H,23,25)(H,24,26)