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

Systemtic Name: N-[(3,4-diethoxyphenyl)methyl]-4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Openeye Name: N-[(3,4-diethoxyphenyl)methyl]-4-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]benzamide CAS Name: N-[(3,4-diethoxyphenyl)methyl]-4-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]benzamide IUPAC Name: N-[(3,4-diethoxyphenyl)methyl]-4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Traditional Name: N-(3,4-diethoxybenzyl)-4-[(4-tosylpiperazino)methyl]benzamide Formula: C30H37N3O5S MolecularWeight: 551.69688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)C2=CC=C(C=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)C2=CC=C(C=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C)OCC

InChI

InChI=1S/C30H37N3O5S/c1-4-37-28-15-10-25(20-29(28)38-5-2)21-31-30(34)26-11-8-24(9-12-26)22-32-16-18-33(19-17-32)39(35,36)27-13-6-23(3)7-14-27/h6-15,20H,4-5,16-19,21-22H2,1-3H3,(H,31,34)