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

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-3-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-3-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide CAS Name: N-(5-chloro-2-methoxyphenyl)-3-[(4-ethylsulfonyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-3-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-3-[(4-esylpiperazino)methyl]benzamide Formula: C21H26ClN3O4S MolecularWeight: 451.96684

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H26ClN3O4S/c1-3-30(27,28)25-11-9-24(10-12-25)15-16-5-4-6-17(13-16)21(26)23-19-14-18(22)7-8-20(19)29-2/h4-8,13-14H,3,9-12,15H2,1-2H3,(H,23,26)