3-[2-[2-(3-bromophenyl)-1,3-thiazol-4-yl]ethanoylamino]-N,N-diethyl-benzamide

Systemtic Name: 3-[2-[2-(3-bromophenyl)-1,3-thiazol-4-yl]ethanoylamino]-N,N-diethyl-benzamide Openeye Name: 3-[[2-[2-(3-bromophenyl)thiazol-4-yl]acetyl]amino]-N,N-diethyl-benzamide CAS Name: 3-[[2-[2-(3-bromophenyl)-4-thiazolyl]-1-oxoethyl]amino]-N,N-diethylbenzamide IUPAC Name: 3-[[2-[2-(3-bromophenyl)-1,3-thiazol-4-yl]acetyl]amino]-N,N-diethylbenzamide Traditional Name: 3-[[2-[2-(3-bromophenyl)thiazol-4-yl]acetyl]amino]-N,N-diethyl-benzamide Formula: C22H22BrN3O2S MolecularWeight: 472.39798

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CC2=CSC(=N2)C3=CC(=CC=C3)Br

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CC2=CSC(=N2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C22H22BrN3O2S/c1-3-26(4-2)22(28)16-8-6-10-18(12-16)24-20(27)13-19-14-29-21(25-19)15-7-5-9-17(23)11-15/h5-12,14H,3-4,13H2,1-2H3,(H,24,27)