4-[[(3-bromanyl-4-methoxy-phenyl)sulfonyl-(4-methylphenyl)amino]methyl]-N-tert-butyl-benzamide

Systemtic Name: 4-[[(3-bromanyl-4-methoxy-phenyl)sulfonyl-(4-methylphenyl)amino]methyl]-N-tert-butyl-benzamide Openeye Name: 4-[(N-(3-bromo-4-methoxy-phenyl)sulfonyl-4-methyl-anilino)methyl]-N-tert-butyl-benzamide CAS Name: 4-[(N-(3-bromo-4-methoxyphenyl)sulfonyl-4-methylanilino)methyl]-N-tert-butylbenzamide IUPAC Name: 4-[(N-(3-bromo-4-methoxyphenyl)sulfonyl-4-methylanilino)methyl]-N-tert-butylbenzamide Traditional Name: 4-[(N-(3-bromo-4-methoxy-phenyl)sulfonyl-4-methyl-anilino)methyl]-N-tert-butyl-benzamide Formula: C26H29BrN2O4S MolecularWeight: 545.48846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC2=CC=C(C=C2)C(=O)NC(C)(C)C)S(=O)(=O)C3=CC(=C(C=C3)OC)Br

Isomeric SMILES

CC1=CC=C(C=C1)N(CC2=CC=C(C=C2)C(=O)NC(C)(C)C)S(=O)(=O)C3=CC(=C(C=C3)OC)Br

InChI

InChI=1S/C26H29BrN2O4S/c1-18-6-12-21(13-7-18)29(34(31,32)22-14-15-24(33-5)23(27)16-22)17-19-8-10-20(11-9-19)25(30)28-26(2,3)4/h6-16H,17H2,1-5H3,(H,28,30)