4-bromanyl-N-[3-oxidanylidene-3-[(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)amino]propyl]benzamide

Systemtic Name: 4-bromanyl-N-[3-oxidanylidene-3-[(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)amino]propyl]benzamide Openeye Name: 4-bromo-N-[3-oxo-3-[[2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]amino]propyl]benzamide CAS Name: 4-bromo-N-[3-oxo-3-[[2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]amino]propyl]benzamide IUPAC Name: 4-bromo-N-[3-oxo-3-[(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)amino]propyl]benzamide Traditional Name: 4-bromo-N-[3-keto-3-[[2-pyrrolidino-2-(2-thienyl)ethyl]amino]propyl]benzamide Formula: C20H24BrN3O2S MolecularWeight: 450.39246

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)CCNC(=O)C2=CC=C(C=C2)Br)C3=CC=CS3

Isomeric SMILES

C1CCN(C1)C(CNC(=O)CCNC(=O)C2=CC=C(C=C2)Br)C3=CC=CS3

InChI

InChI=1S/C20H24BrN3O2S/c21-16-7-5-15(6-8-16)20(26)22-10-9-19(25)23-14-17(18-4-3-13-27-18)24-11-1-2-12-24/h3-8,13,17H,1-2,9-12,14H2,(H,22,26)(H,23,25)