2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]-N-[(3,4,5-trimethoxyphenyl)methyl]ethanamide

Systemtic Name: 2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]-N-[(3,4,5-trimethoxyphenyl)methyl]ethanamide Openeye Name: 2-[4-(3-thienylmethyl)piperazin-1-yl]-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide CAS Name: 2-[4-(3-thiophenylmethyl)-1-piperazinyl]-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide IUPAC Name: 2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide Traditional Name: 2-[4-(3-thenyl)piperazino]-N-(3,4,5-trimethoxybenzyl)acetamide Formula: C21H29N3O4S MolecularWeight: 419.53766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC(=O)CN2CCN(CC2)CC3=CSC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC(=O)CN2CCN(CC2)CC3=CSC=C3

InChI

InChI=1S/C21H29N3O4S/c1-26-18-10-17(11-19(27-2)21(18)28-3)12-22-20(25)14-24-7-5-23(6-8-24)13-16-4-9-29-15-16/h4,9-11,15H,5-8,12-14H2,1-3H3,(H,22,25)