3-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-(2-phenylsulfanylphenyl)benzamide

Systemtic Name: 3-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-(2-phenylsulfanylphenyl)benzamide Openeye Name: 3-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-(2-phenylsulfanylphenyl)benzamide CAS Name: 3-[(4-ethylsulfonyl-1-piperazinyl)methyl]-N-[2-(phenylthio)phenyl]benzamide IUPAC Name: 3-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-(2-phenylsulfanylphenyl)benzamide Traditional Name: 3-[(4-esylpiperazino)methyl]-N-[2-(phenylthio)phenyl]benzamide Formula: C26H29N3O3S2 MolecularWeight: 495.65676

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(CC1)CC2=CC=CC(=C2)C(=O)NC3=CC=CC=C3SC4=CC=CC=C4

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)CC2=CC=CC(=C2)C(=O)NC3=CC=CC=C3SC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O3S2/c1-2-34(31,32)29-17-15-28(16-18-29)20-21-9-8-10-22(19-21)26(30)27-24-13-6-7-14-25(24)33-23-11-4-3-5-12-23/h3-14,19H,2,15-18,20H2,1H3,(H,27,30)