1-(phenylmethyl)-3-[4-(2-thiophen-2-ylethanoyl)piperazin-1-yl]quinoxalin-2-one

Systemtic Name: 1-(phenylmethyl)-3-[4-(2-thiophen-2-ylethanoyl)piperazin-1-yl]quinoxalin-2-one Openeye Name: 1-benzyl-3-[4-[2-(2-thienyl)acetyl]piperazin-1-yl]quinoxalin-2-one CAS Name: 3-[4-(1-oxo-2-thiophen-2-ylethyl)-1-piperazinyl]-1-(phenylmethyl)-2-quinoxalinone IUPAC Name: 1-benzyl-3-[4-(2-thiophen-2-ylacetyl)piperazin-1-yl]quinoxalin-2-one Traditional Name: 1-benzyl-3-[4-[2-(2-thienyl)acetyl]piperazino]quinoxalin-2-one Formula: C25H24N4O2S MolecularWeight: 444.54866

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=CC=CC=C3N(C2=O)CC4=CC=CC=C4)C(=O)CC5=CC=CS5

Isomeric SMILES

C1CN(CCN1C2=NC3=CC=CC=C3N(C2=O)CC4=CC=CC=C4)C(=O)CC5=CC=CS5

InChI

InChI=1S/C25H24N4O2S/c30-23(17-20-9-6-16-32-20)27-12-14-28(15-13-27)24-25(31)29(18-19-7-2-1-3-8-19)22-11-5-4-10-21(22)26-24/h1-11,16H,12-15,17-18H2