2-[(5-bromanyl-2-phenethyloxy-phenyl)carbonylamino]-4-methyl-5-(phenylmethyl)thiophene-3-carboxamide

Systemtic Name: 2-[(5-bromanyl-2-phenethyloxy-phenyl)carbonylamino]-4-methyl-5-(phenylmethyl)thiophene-3-carboxamide Openeye Name: 5-benzyl-2-[(5-bromo-2-phenethyloxy-benzoyl)amino]-4-methyl-thiophene-3-carboxamide CAS Name: 2-[[(5-bromo-2-phenethyloxyphenyl)-oxomethyl]amino]-4-methyl-5-(phenylmethyl)-3-thiophenecarboxamide IUPAC Name: 5-benzyl-2-[(5-bromo-2-phenethyloxybenzoyl)amino]-4-methylthiophene-3-carboxamide Traditional Name: 5-benzyl-2-[(5-bromo-2-phenethyloxy-benzoyl)amino]-4-methyl-thiophene-3-carboxamide Formula: C28H25BrN2O3S MolecularWeight: 549.4787

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C28H25BrN2O3S/c1-18-24(16-20-10-6-3-7-11-20)35-28(25(18)26(30)32)31-27(33)22-17-21(29)12-13-23(22)34-15-14-19-8-4-2-5-9-19/h2-13,17H,14-16H2,1H3,(H2,30,32)(H,31,33)