3-bromanyl-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-yl-ethyl]benzamide

Systemtic Name: 3-bromanyl-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-yl-ethyl]benzamide Openeye Name: 3-bromo-N-[2-(4-methylpiperazin-1-yl)-2-(3-thienyl)ethyl]benzamide CAS Name: 3-bromo-N-[2-(4-methyl-1-piperazinyl)-2-(3-thiophenyl)ethyl]benzamide IUPAC Name: 3-bromo-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-ylethyl]benzamide Traditional Name: 3-bromo-N-[2-(4-methylpiperazino)-2-(3-thienyl)ethyl]benzamide Formula: C18H22BrN3OS MolecularWeight: 408.35578

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(CNC(=O)C2=CC(=CC=C2)Br)C3=CSC=C3

Isomeric SMILES

CN1CCN(CC1)C(CNC(=O)C2=CC(=CC=C2)Br)C3=CSC=C3

InChI

InChI=1S/C18H22BrN3OS/c1-21-6-8-22(9-7-21)17(15-5-10-24-13-15)12-20-18(23)14-3-2-4-16(19)11-14/h2-5,10-11,13,17H,6-9,12H2,1H3,(H,20,23)