N-(2,6-dimethylphenyl)-2-[4-(2-thiophen-3-ylethanoyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[4-(2-thiophen-3-ylethanoyl)piperazin-1-yl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[4-[2-(3-thienyl)acetyl]piperazin-1-yl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[4-[1-oxo-2-(3-thiophenyl)ethyl]-1-piperazinyl]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-(2-thiophen-3-ylacetyl)piperazin-1-yl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[4-[2-(3-thienyl)acetyl]piperazino]acetamide Formula: C20H25N3O2S MolecularWeight: 371.4964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)C(=O)CC3=CSC=C3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)C(=O)CC3=CSC=C3

InChI

InChI=1S/C20H25N3O2S/c1-15-4-3-5-16(2)20(15)21-18(24)13-22-7-9-23(10-8-22)19(25)12-17-6-11-26-14-17/h3-6,11,14H,7-10,12-13H2,1-2H3,(H,21,24)