4-(4-bromanylpyrazol-1-yl)-N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]benzamide

Systemtic Name: 4-(4-bromanylpyrazol-1-yl)-N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]benzamide Openeye Name: 4-(4-bromopyrazol-1-yl)-N-[2-(dimethylamino)-2-(3-thienyl)ethyl]benzamide CAS Name: 4-(4-bromo-1-pyrazolyl)-N-[2-(dimethylamino)-2-(3-thiophenyl)ethyl]benzamide IUPAC Name: 4-(4-bromopyrazol-1-yl)-N-[2-(dimethylamino)-2-thiophen-3-ylethyl]benzamide Traditional Name: 4-(4-bromopyrazol-1-yl)-N-[2-(dimethylamino)-2-(3-thienyl)ethyl]benzamide Formula: C18H19BrN4OS MolecularWeight: 419.33866

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1=CC=C(C=C1)N2C=C(C=N2)Br)C3=CSC=C3

Isomeric SMILES

CN(C)C(CNC(=O)C1=CC=C(C=C1)N2C=C(C=N2)Br)C3=CSC=C3

InChI

InChI=1S/C18H19BrN4OS/c1-22(2)17(14-7-8-25-12-14)10-20-18(24)13-3-5-16(6-4-13)23-11-15(19)9-21-23/h3-9,11-12,17H,10H2,1-2H3,(H,20,24)