N-[3-[(3-bromophenyl)-piperidin-1-yl-methyl]-5-methyl-thiophen-2-yl]furan-2-carboxamide

Systemtic Name: N-[3-[(3-bromophenyl)-piperidin-1-yl-methyl]-5-methyl-thiophen-2-yl]furan-2-carboxamide Openeye Name: N-[3-[(3-bromophenyl)-(1-piperidyl)methyl]-5-methyl-2-thienyl]furan-2-carboxamide CAS Name: N-[3-[(3-bromophenyl)-(1-piperidinyl)methyl]-5-methyl-2-thiophenyl]-2-furancarboxamide IUPAC Name: N-[3-[(3-bromophenyl)-piperidin-1-ylmethyl]-5-methylthiophen-2-yl]furan-2-carboxamide Traditional Name: N-[3-[(3-bromophenyl)-piperidino-methyl]-5-methyl-2-thienyl]-2-furamide Formula: C22H23BrN2O2S MolecularWeight: 459.39922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C2=CC=CO2)C(C3=CC(=CC=C3)Br)N4CCCCC4

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)C2=CC=CO2)C(C3=CC(=CC=C3)Br)N4CCCCC4

InChI

InChI=1S/C22H23BrN2O2S/c1-15-13-18(22(28-15)24-21(26)19-9-6-12-27-19)20(25-10-3-2-4-11-25)16-7-5-8-17(23)14-16/h5-9,12-14,20H,2-4,10-11H2,1H3,(H,24,26)