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

Systemtic Name: 4,5-bis(bromanyl)-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]thiophene-2-carboxamide Openeye Name: 4,5-dibromo-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]thiophene-2-carboxamide CAS Name: 4,5-dibromo-N-[2-(2-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-2-thiophenecarboxamide IUPAC Name: 4,5-dibromo-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]thiophene-2-carboxamide Traditional Name: 4,5-dibromo-N-[2-(2-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=C1C(CNC(=O)C2=CC(=C(S2)Br)Br)N3CCCC3

Isomeric SMILES

COC1=CC=CC=C1C(CNC(=O)C2=CC(=C(S2)Br)Br)N3CCCC3

InChI

InChI=1S/C18H20Br2N2O2S/c1-24-15-7-3-2-6-12(15)14(22-8-4-5-9-22)11-21-18(23)16-10-13(19)17(20)25-16/h2-3,6-7,10,14H,4-5,8-9,11H2,1H3,(H,21,23)