N-tert-butyl-2-[2-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]ethanoylamino]benzamide

Systemtic Name: N-tert-butyl-2-[2-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]ethanoylamino]benzamide Openeye Name: N-tert-butyl-2-[[2-(3-chloro-4-methoxy-N-methylsulfonyl-anilino)acetyl]amino]benzamide CAS Name: N-tert-butyl-2-[[2-(3-chloro-4-methoxy-N-methylsulfonylanilino)-1-oxoethyl]amino]benzamide IUPAC Name: N-tert-butyl-2-[[2-(3-chloro-4-methoxy-N-methylsulfonylanilino)acetyl]amino]benzamide Traditional Name: N-tert-butyl-2-[[2-(3-chloro-N-mesyl-4-methoxy-anilino)acetyl]amino]benzamide Formula: C21H26ClN3O5S MolecularWeight: 467.96624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC(=C(C=C2)OC)Cl)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC(=C(C=C2)OC)Cl)S(=O)(=O)C

InChI

InChI=1S/C21H26ClN3O5S/c1-21(2,3)24-20(27)15-8-6-7-9-17(15)23-19(26)13-25(31(5,28)29)14-10-11-18(30-4)16(22)12-14/h6-12H,13H2,1-5H3,(H,23,26)(H,24,27)