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

Systemtic Name: 3-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-(3-prop-2-enoxyphenyl)benzamide Openeye Name: N-(3-allyloxyphenyl)-3-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide CAS Name: 3-[(4-ethylsulfonyl-1-piperazinyl)methyl]-N-(3-prop-2-enoxyphenyl)benzamide IUPAC Name: 3-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-(3-prop-2-enoxyphenyl)benzamide Traditional Name: N-(3-allyloxyphenyl)-3-[(4-esylpiperazino)methyl]benzamide Formula: C23H29N3O4S MolecularWeight: 443.55906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O4S/c1-3-15-30-22-10-6-9-21(17-22)24-23(27)20-8-5-7-19(16-20)18-25-11-13-26(14-12-25)31(28,29)4-2/h3,5-10,16-17H,1,4,11-15,18H2,2H3,(H,24,27)