ethyl 4-[2-[(3,5-dimethylphenyl)-(2-methoxy-5-methyl-phenyl)sulfonyl-amino]ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(3,5-dimethylphenyl)-(2-methoxy-5-methyl-phenyl)sulfonyl-amino]ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(N-(2-methoxy-5-methyl-phenyl)sulfonyl-3,5-dimethyl-anilino)acetyl]piperazine-1-carboxylate CAS Name: 4-[2-(N-(2-methoxy-5-methylphenyl)sulfonyl-3,5-dimethylanilino)-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(N-(2-methoxy-5-methylphenyl)sulfonyl-3,5-dimethylanilino)acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(N-(2-methoxy-5-methyl-phenyl)sulfonyl-3,5-dimethyl-anilino)acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C25H33N3O6S MolecularWeight: 503.61102

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CN(C2=CC(=CC(=C2)C)C)S(=O)(=O)C3=C(C=CC(=C3)C)OC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CN(C2=CC(=CC(=C2)C)C)S(=O)(=O)C3=C(C=CC(=C3)C)OC

InChI

InChI=1S/C25H33N3O6S/c1-6-34-25(30)27-11-9-26(10-12-27)24(29)17-28(21-14-19(3)13-20(4)15-21)35(31,32)23-16-18(2)7-8-22(23)33-5/h7-8,13-16H,6,9-12,17H2,1-5H3