1-[2-oxidanylidene-2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]ethyl]cinnolin-4-one

Systemtic Name: 1-[2-oxidanylidene-2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]ethyl]cinnolin-4-one Openeye Name: 1-[2-oxo-2-[4-(3-thienylmethyl)piperazin-1-yl]ethyl]cinnolin-4-one CAS Name: 1-[2-oxo-2-[4-(3-thiophenylmethyl)-1-piperazinyl]ethyl]-4-cinnolinone IUPAC Name: 1-[2-oxo-2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]ethyl]cinnolin-4-one Traditional Name: 1-[2-keto-2-[4-(3-thenyl)piperazino]ethyl]cinnolin-4-one Formula: C19H20N4O2S MolecularWeight: 368.4527

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CSC=C2)C(=O)CN3C4=CC=CC=C4C(=O)C=N3

Isomeric SMILES

C1CN(CCN1CC2=CSC=C2)C(=O)CN3C4=CC=CC=C4C(=O)C=N3

InChI

InChI=1S/C19H20N4O2S/c24-18-11-20-23(17-4-2-1-3-16(17)18)13-19(25)22-8-6-21(7-9-22)12-15-5-10-26-14-15/h1-5,10-11,14H,6-9,12-13H2