N-(4,6-dimethylpyrimidin-2-yl)-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(4,6-dimethylpyrimidin-2-yl)-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-(4,6-dimethylpyrimidin-2-yl)benzamide CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]-N-(4,6-dimethyl-2-pyrimidinyl)benzamide IUPAC Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-(4,6-dimethylpyrimidin-2-yl)benzamide Traditional Name: 3-(4-acetylpiperazino)sulfonyl-N-(4,6-dimethylpyrimidin-2-yl)benzamide Formula: C19H23N5O4S MolecularWeight: 417.48202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C(=O)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C(=O)C)C

InChI

InChI=1S/C19H23N5O4S/c1-13-11-14(2)21-19(20-13)22-18(26)16-5-4-6-17(12-16)29(27,28)24-9-7-23(8-10-24)15(3)25/h4-6,11-12H,7-10H2,1-3H3,(H,20,21,22,26)