2-[2-(2-bromanyl-4-phenyl-phenoxy)ethanoylamino]-4,5-dimethyl-thiophene-3-carboxamide

Systemtic Name: 2-[2-(2-bromanyl-4-phenyl-phenoxy)ethanoylamino]-4,5-dimethyl-thiophene-3-carboxamide Openeye Name: 2-[[2-(2-bromo-4-phenyl-phenoxy)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxamide CAS Name: 2-[[2-(2-bromo-4-phenylphenoxy)-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxamide IUPAC Name: 2-[[2-(2-bromo-4-phenylphenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxamide Traditional Name: 2-[[2-(2-bromo-4-phenyl-phenoxy)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxamide Formula: C21H19BrN2O3S MolecularWeight: 459.35616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=O)COC2=C(C=C(C=C2)C3=CC=CC=C3)Br)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)COC2=C(C=C(C=C2)C3=CC=CC=C3)Br)C

InChI

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