[1,1-bis(oxidanylidene)-1-benzothiophen-4-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: [1,1-bis(oxidanylidene)-1-benzothiophen-4-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone Openeye Name: (1,1-dioxobenzothiophen-4-yl)-[4-(3-pyridylmethyl)piperazin-1-yl]methanone CAS Name: (1,1-dioxo-1-benzothiophen-4-yl)-[4-(3-pyridinylmethyl)-1-piperazinyl]methanone IUPAC Name: (1,1-dioxo-1-benzothiophen-4-yl)-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone Traditional Name: (1,1-diketobenzothiophen-4-yl)-[4-(3-pyridylmethyl)piperazino]methanone Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CN=CC=C2)C(=O)C3=C4C=CS(=O)(=O)C4=CC=C3

Isomeric SMILES

C1CN(CCN1CC2=CN=CC=C2)C(=O)C3=C4C=CS(=O)(=O)C4=CC=C3

InChI

InChI=1S/C19H19N3O3S/c23-19(17-4-1-5-18-16(17)6-12-26(18,24)25)22-10-8-21(9-11-22)14-15-3-2-7-20-13-15/h1-7,12-13H,8-11,14H2