1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-3-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propan-1-one

Systemtic Name: 1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-3-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propan-1-one Openeye Name: 1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-3-(4-thiazol-2-ylpiperazin-1-yl)propan-1-one CAS Name: 1-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-3-[4-(2-thiazolyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-3-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propan-1-one Traditional Name: 1-(4-pyridin-1-ium-2-ylpiperazino)-3-(4-thiazol-2-ylpiperazino)propan-1-one Formula: C19H27N6OS+ MolecularWeight: 387.52228

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)N2CCN(CC2)C3=CC=CC=[NH+]3)C4=NC=CS4

Isomeric SMILES

C1CN(CCN1CCC(=O)N2CCN(CC2)C3=CC=CC=[NH+]3)C4=NC=CS4

InChI

InChI=1S/C19H26N6OS/c26-18(24-14-12-23(13-15-24)17-3-1-2-5-20-17)4-7-22-8-10-25(11-9-22)19-21-6-16-27-19/h1-3,5-6,16H,4,7-15H2/p+1