2-piperazin-4-ium-1-yl-1,3-thiazole-5-carbaldehyde

Systemtic Name: 2-piperazin-4-ium-1-yl-1,3-thiazole-5-carbaldehyde Openeye Name: 2-piperazin-4-ium-1-ylthiazole-5-carbaldehyde CAS Name: 2-(1-piperazin-4-iumyl)-5-thiazolecarboxaldehyde IUPAC Name: 2-piperazin-4-ium-1-yl-1,3-thiazole-5-carbaldehyde Traditional Name: 2-piperazin-4-ium-1-ylthiazole-5-carbaldehyde Formula: C8H12N3OS+ MolecularWeight: 198.26538

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=NC=C(S2)C=O

Isomeric SMILES

C1CN(CC[NH2+]1)C2=NC=C(S2)C=O

InChI

InChI=1S/C8H11N3OS/c12-6-7-5-10-8(13-7)11-3-1-9-2-4-11/h5-6,9H,1-4H2/p+1