N-[(4-methylphenyl)-thiophen-2-yl-methyl]-2-(3-oxidanylidenepiperazin-1-yl)ethanamide

Systemtic Name: N-[(4-methylphenyl)-thiophen-2-yl-methyl]-2-(3-oxidanylidenepiperazin-1-yl)ethanamide Openeye Name: 2-(3-oxopiperazin-1-yl)-N-[p-tolyl(2-thienyl)methyl]acetamide CAS Name: N-[(4-methylphenyl)-thiophen-2-ylmethyl]-2-(3-oxo-1-piperazinyl)acetamide IUPAC Name: N-[(4-methylphenyl)-thiophen-2-ylmethyl]-2-(3-oxopiperazin-1-yl)acetamide Traditional Name: 2-(3-ketopiperazino)-N-[p-tolyl(2-thienyl)methyl]acetamide Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CN3CCNC(=O)C3

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CN3CCNC(=O)C3

InChI

InChI=1S/C18H21N3O2S/c1-13-4-6-14(7-5-13)18(15-3-2-10-24-15)20-17(23)12-21-9-8-19-16(22)11-21/h2-7,10,18H,8-9,11-12H2,1H3,(H,19,22)(H,20,23)