4-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)-1,3-thiazole-5-carbaldehyde

Systemtic Name: 4-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)-1,3-thiazole-5-carbaldehyde Openeye Name: 4-chloro-2-(4-methylpiperazin-4-ium-1-yl)thiazole-5-carbaldehyde CAS Name: 4-chloro-2-(4-methyl-1-piperazin-4-iumyl)-5-thiazolecarboxaldehyde IUPAC Name: 4-chloro-2-(4-methylpiperazin-4-ium-1-yl)-1,3-thiazole-5-carbaldehyde Traditional Name: 4-chloro-2-(4-methylpiperazin-4-ium-1-yl)thiazole-5-carbaldehyde Formula: C9H13ClN3OS+ MolecularWeight: 246.73702

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC(=C(S2)C=O)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC(=C(S2)C=O)Cl

InChI

InChI=1S/C9H12ClN3OS/c1-12-2-4-13(5-3-12)9-11-8(10)7(6-14)15-9/h6H,2-5H2,1H3/p+1