2-[[(E)-3-[3-[(4-bromanylphenoxy)methyl]-4-methoxy-phenyl]prop-2-enoyl]amino]-5-propan-2-yl-thiophene-3-carboxamide

Systemtic Name: 2-[[(E)-3-[3-[(4-bromanylphenoxy)methyl]-4-methoxy-phenyl]prop-2-enoyl]amino]-5-propan-2-yl-thiophene-3-carboxamide Openeye Name: 2-[[(E)-3-[3-[(4-bromophenoxy)methyl]-4-methoxy-phenyl]prop-2-enoyl]amino]-5-isopropyl-thiophene-3-carboxamide CAS Name: 2-[[(E)-3-[3-[(4-bromophenoxy)methyl]-4-methoxyphenyl]-1-oxoprop-2-enyl]amino]-5-propan-2-yl-3-thiophenecarboxamide IUPAC Name: 2-[[(E)-3-[3-[(4-bromophenoxy)methyl]-4-methoxyphenyl]prop-2-enoyl]amino]-5-propan-2-ylthiophene-3-carboxamide Traditional Name: 2-[[(E)-3-[3-[(4-bromophenoxy)methyl]-4-methoxy-phenyl]acryloyl]amino]-5-isopropyl-thiophene-3-carboxamide Formula: C25H25BrN2O4S MolecularWeight: 529.446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(S1)NC(=O)C=CC2=CC(=C(C=C2)OC)COC3=CC=C(C=C3)Br)C(=O)N

Isomeric SMILES

CC(C)C1=CC(=C(S1)NC(=O)/C=C/C2=CC(=C(C=C2)OC)COC3=CC=C(C=C3)Br)C(=O)N

InChI

InChI=1S/C25H25BrN2O4S/c1-15(2)22-13-20(24(27)30)25(33-22)28-23(29)11-5-16-4-10-21(31-3)17(12-16)14-32-19-8-6-18(26)7-9-19/h4-13,15H,14H2,1-3H3,(H2,27,30)(H,28,29)/b11-5+