2-[(4-ethoxyphenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]-N-[(4-piperidin-1-ylphenyl)methyl]ethanamide

Systemtic Name: 2-[(4-ethoxyphenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]-N-[(4-piperidin-1-ylphenyl)methyl]ethanamide Openeye Name: 2-(4-ethoxy-N-(4-methylsulfanylphenyl)sulfonyl-anilino)-N-[[4-(1-piperidyl)phenyl]methyl]acetamide CAS Name: 2-(4-ethoxy-N-[4-(methylthio)phenyl]sulfonylanilino)-N-[[4-(1-piperidinyl)phenyl]methyl]acetamide IUPAC Name: 2-(4-ethoxy-N-(4-methylsulfanylphenyl)sulfonylanilino)-N-[(4-piperidin-1-ylphenyl)methyl]acetamide Traditional Name: 2-(4-ethoxy-N-[4-(methylthio)phenyl]sulfonyl-anilino)-N-(4-piperidinobenzyl)acetamide Formula: C29H35N3O4S2 MolecularWeight: 553.7359

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CC(=O)NCC2=CC=C(C=C2)N3CCCCC3)S(=O)(=O)C4=CC=C(C=C4)SC

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CC(=O)NCC2=CC=C(C=C2)N3CCCCC3)S(=O)(=O)C4=CC=C(C=C4)SC

InChI

InChI=1S/C29H35N3O4S2/c1-3-36-26-13-11-25(12-14-26)32(38(34,35)28-17-15-27(37-2)16-18-28)22-29(33)30-21-23-7-9-24(10-8-23)31-19-5-4-6-20-31/h7-18H,3-6,19-22H2,1-2H3,(H,30,33)