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

Systemtic Name: 4-tert-butyl-N-[3-[2-[(4-methylphenyl)-methylsulfonyl-amino]ethanoylamino]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[[2-(4-methyl-N-methylsulfonyl-anilino)acetyl]amino]phenyl]benzamide CAS Name: 4-tert-butyl-N-[3-[[2-(4-methyl-N-methylsulfonylanilino)-1-oxoethyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[[2-(4-methyl-N-methylsulfonylanilino)acetyl]amino]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[[2-(N-mesyl-4-methyl-anilino)acetyl]amino]phenyl]benzamide Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)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=CC=C(C=C1)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/C27H31N3O4S/c1-19-9-15-24(16-10-19)30(35(5,33)34)18-25(31)28-22-7-6-8-23(17-22)29-26(32)20-11-13-21(14-12-20)27(2,3)4/h6-17H,18H2,1-5H3,(H,28,31)(H,29,32)