N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[2-(4-methylsulfonylpiperazin-1-yl)ethanoylamino]benzamide

Systemtic Name: N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[2-(4-methylsulfonylpiperazin-1-yl)ethanoylamino]benzamide Openeye Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[[2-(4-methylsulfonylpiperazin-1-yl)acetyl]amino]benzamide CAS Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[[2-(4-methylsulfonyl-1-piperazinyl)-1-oxoethyl]amino]benzamide IUPAC Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[[2-(4-methylsulfonylpiperazin-1-yl)acetyl]amino]benzamide Traditional Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[[2-(4-mesylpiperazino)acetyl]amino]benzamide Formula: C22H27ClN4O5S MolecularWeight: 494.99158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)C2=CC=CC=C2NC(=O)CN3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)C2=CC=CC=C2NC(=O)CN3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C22H27ClN4O5S/c1-15-12-19(20(32-2)13-17(15)23)25-22(29)16-6-4-5-7-18(16)24-21(28)14-26-8-10-27(11-9-26)33(3,30)31/h4-7,12-13H,8-11,14H2,1-3H3,(H,24,28)(H,25,29)