N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-4-(2-phenylsulfanylethoxy)benzamide

Systemtic Name: N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-4-(2-phenylsulfanylethoxy)benzamide Openeye Name: N-[2-methoxy-5-(1-piperidylsulfonyl)phenyl]-4-(2-phenylsulfanylethoxy)benzamide CAS Name: N-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]-4-[2-(phenylthio)ethoxy]benzamide IUPAC Name: N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-4-(2-phenylsulfanylethoxy)benzamide Traditional Name: N-(2-methoxy-5-piperidinosulfonyl-phenyl)-4-[2-(phenylthio)ethoxy]benzamide Formula: C27H30N2O5S2 MolecularWeight: 526.6675

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=C(C=C3)OCCSC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=C(C=C3)OCCSC4=CC=CC=C4

InChI

InChI=1S/C27H30N2O5S2/c1-33-26-15-14-24(36(31,32)29-16-6-3-7-17-29)20-25(26)28-27(30)21-10-12-22(13-11-21)34-18-19-35-23-8-4-2-5-9-23/h2,4-5,8-15,20H,3,6-7,16-19H2,1H3,(H,28,30)