N-[(3,4-diethoxyphenyl)methyl]-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide

Systemtic Name: N-[(3,4-diethoxyphenyl)methyl]-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide Openeye Name: N-[(3,4-diethoxyphenyl)methyl]-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide CAS Name: N-[(3,4-diethoxyphenyl)methyl]-3-[(4-methylsulfonyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-[(3,4-diethoxyphenyl)methyl]-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide Traditional Name: N-(3,4-diethoxybenzyl)-3-[(4-mesylpiperazino)methyl]benzamide Formula: C24H33N3O5S MolecularWeight: 475.60092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)C2=CC(=CC=C2)CN3CCN(CC3)S(=O)(=O)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)C2=CC(=CC=C2)CN3CCN(CC3)S(=O)(=O)C)OCC

InChI

InChI=1S/C24H33N3O5S/c1-4-31-22-10-9-19(16-23(22)32-5-2)17-25-24(28)21-8-6-7-20(15-21)18-26-11-13-27(14-12-26)33(3,29)30/h6-10,15-16H,4-5,11-14,17-18H2,1-3H3,(H,25,28)