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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)CN(C2=CC=C(C=C2)C)S(=O)(=O)C3=CC(=C(C=C3)OC)Br

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)CN(C2=CC=C(C=C2)C)S(=O)(=O)C3=CC(=C(C=C3)OC)Br

InChI

InChI=1S/C26H29BrN2O4S/c1-5-28(6-2)26(30)21-11-9-20(10-12-21)18-29(22-13-7-19(3)8-14-22)34(31,32)23-15-16-25(33-4)24(27)17-23/h7-17H,5-6,18H2,1-4H3