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

Systemtic Name: 4-tert-butyl-N-[3-[2-[(3-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]ethanoylamino]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[[2-(3-chloro-2-methyl-N-methylsulfonyl-anilino)acetyl]amino]phenyl]benzamide CAS Name: 4-tert-butyl-N-[3-[[2-(3-chloro-2-methyl-N-methylsulfonylanilino)-1-oxoethyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[[2-(3-chloro-2-methyl-N-methylsulfonylanilino)acetyl]amino]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[[2-(3-chloro-N-mesyl-2-methyl-anilino)acetyl]amino]phenyl]benzamide Formula: C27H30ClN3O4S MolecularWeight: 528.0628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N(CC(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)N(CC(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)S(=O)(=O)C

InChI

InChI=1S/C27H30ClN3O4S/c1-18-23(28)10-7-11-24(18)31(36(5,34)35)17-25(32)29-21-8-6-9-22(16-21)30-26(33)19-12-14-20(15-13-19)27(2,3)4/h6-16H,17H2,1-5H3,(H,29,32)(H,30,33)