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

Systemtic Name: 5-bromanyl-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]thiophene-3-carboxamide Openeye Name: 5-bromo-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]thiophene-3-carboxamide CAS Name: 5-bromo-N-[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-3-thiophenecarboxamide IUPAC Name: 5-bromo-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]thiophene-3-carboxamide Traditional Name: 5-bromo-N-[2-(3-methoxyphenyl)-2-pyrrolidino-ethyl]thiophene-3-carboxamide Formula: C18H21BrN2O2S MolecularWeight: 409.34054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21BrN2O2S/c1-23-15-6-4-5-13(9-15)16(21-7-2-3-8-21)11-20-18(22)14-10-17(19)24-12-14/h4-6,9-10,12,16H,2-3,7-8,11H2,1H3,(H,20,22)