N-[5-chloranyl-2-(2-methoxyphenoxy)phenyl]-3-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide

Systemtic Name: N-[5-chloranyl-2-(2-methoxyphenoxy)phenyl]-3-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide Openeye Name: N-[5-chloro-2-(2-methoxyphenoxy)phenyl]-3-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide CAS Name: N-[5-chloro-2-(2-methoxyphenoxy)phenyl]-3-[(4-ethylsulfonyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-[5-chloro-2-(2-methoxyphenoxy)phenyl]-3-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide Traditional Name: N-[5-chloro-2-(2-methoxyphenoxy)phenyl]-3-[(4-esylpiperazino)methyl]benzamide Formula: C27H30ClN3O5S MolecularWeight: 544.0622

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(CC1)CC2=CC=CC(=C2)C(=O)NC3=C(C=CC(=C3)Cl)OC4=CC=CC=C4OC

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)CC2=CC=CC(=C2)C(=O)NC3=C(C=CC(=C3)Cl)OC4=CC=CC=C4OC

InChI

InChI=1S/C27H30ClN3O5S/c1-3-37(33,34)31-15-13-30(14-16-31)19-20-7-6-8-21(17-20)27(32)29-23-18-22(28)11-12-24(23)36-26-10-5-4-9-25(26)35-2/h4-12,17-18H,3,13-16,19H2,1-2H3,(H,29,32)