2-[2-[(4-ethoxyphenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]ethanoylamino]-N-(2-methoxyethyl)benzamide

Systemtic Name: 2-[2-[(4-ethoxyphenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]ethanoylamino]-N-(2-methoxyethyl)benzamide Openeye Name: 2-[[2-(4-ethoxy-N-(4-methylsulfanylphenyl)sulfonyl-anilino)acetyl]amino]-N-(2-methoxyethyl)benzamide CAS Name: 2-[[2-(4-ethoxy-N-[4-(methylthio)phenyl]sulfonylanilino)-1-oxoethyl]amino]-N-(2-methoxyethyl)benzamide IUPAC Name: 2-[[2-(4-ethoxy-N-(4-methylsulfanylphenyl)sulfonylanilino)acetyl]amino]-N-(2-methoxyethyl)benzamide Traditional Name: 2-[[2-(4-ethoxy-N-[4-(methylthio)phenyl]sulfonyl-anilino)acetyl]amino]-N-(2-methoxyethyl)benzamide Formula: C27H31N3O6S2 MolecularWeight: 557.68154

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CC(=O)NC2=CC=CC=C2C(=O)NCCOC)S(=O)(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CC(=O)NC2=CC=CC=C2C(=O)NCCOC)S(=O)(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C27H31N3O6S2/c1-4-36-21-11-9-20(10-12-21)30(38(33,34)23-15-13-22(37-3)14-16-23)19-26(31)29-25-8-6-5-7-24(25)27(32)28-17-18-35-2/h5-16H,4,17-19H2,1-3H3,(H,28,32)(H,29,31)