4,5-bis(bromanyl)-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]thiophene-2-carboxamide

Systemtic Name: 4,5-bis(bromanyl)-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]thiophene-2-carboxamide Openeye Name: 4,5-dibromo-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]thiophene-2-carboxamide CAS Name: 4,5-dibromo-N-[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-2-thiophenecarboxamide IUPAC Name: 4,5-dibromo-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]thiophene-2-carboxamide Traditional Name: 4,5-dibromo-N-[2-(3-methoxyphenyl)-2-pyrrolidino-ethyl]thiophene-2-carboxamide Formula: C18H20Br2N2O2S MolecularWeight: 488.2366

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CNC(=O)C2=CC(=C(S2)Br)Br)N3CCCC3

Isomeric SMILES

COC1=CC=CC(=C1)C(CNC(=O)C2=CC(=C(S2)Br)Br)N3CCCC3

InChI

InChI=1S/C18H20Br2N2O2S/c1-24-13-6-4-5-12(9-13)15(22-7-2-3-8-22)11-21-18(23)16-10-14(19)17(20)25-16/h4-6,9-10,15H,2-3,7-8,11H2,1H3,(H,21,23)