2-[2-(2-bromanyl-4-phenyl-phenoxy)ethanoylamino]-4-methyl-5-(phenylmethyl)thiophene-3-carboxamide

Systemtic Name: 2-[2-(2-bromanyl-4-phenyl-phenoxy)ethanoylamino]-4-methyl-5-(phenylmethyl)thiophene-3-carboxamide Openeye Name: 5-benzyl-2-[[2-(2-bromo-4-phenyl-phenoxy)acetyl]amino]-4-methyl-thiophene-3-carboxamide CAS Name: 2-[[2-(2-bromo-4-phenylphenoxy)-1-oxoethyl]amino]-4-methyl-5-(phenylmethyl)-3-thiophenecarboxamide IUPAC Name: 5-benzyl-2-[[2-(2-bromo-4-phenylphenoxy)acetyl]amino]-4-methylthiophene-3-carboxamide Traditional Name: 5-benzyl-2-[[2-(2-bromo-4-phenyl-phenoxy)acetyl]amino]-4-methyl-thiophene-3-carboxamide Formula: C27H23BrN2O3S MolecularWeight: 535.45212

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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)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)COC2=C(C=C(C=C2)C3=CC=CC=C3)Br)CC4=CC=CC=C4

InChI

InChI=1S/C27H23BrN2O3S/c1-17-23(14-18-8-4-2-5-9-18)34-27(25(17)26(29)32)30-24(31)16-33-22-13-12-20(15-21(22)28)19-10-6-3-7-11-19/h2-13,15H,14,16H2,1H3,(H2,29,32)(H,30,31)