4-[[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-ium-1-yl]methyl]-2-methyl-1,3-thiazole

Systemtic Name: 4-[[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-ium-1-yl]methyl]-2-methyl-1,3-thiazole Openeye Name: 4-[[4-[(5-chloro-2-thienyl)methyl]piperazin-1-ium-1-yl]methyl]-2-methyl-thiazole CAS Name: 4-[[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazin-1-iumyl]methyl]-2-methylthiazole IUPAC Name: 4-[[4-[(5-chlorothiophen-2-yl)methyl]piperazin-1-ium-1-yl]methyl]-2-methyl-1,3-thiazole Traditional Name: 4-[[4-[(5-chloro-2-thienyl)methyl]piperazin-1-ium-1-yl]methyl]-2-methyl-thiazole Formula: C14H19ClN3S2+ MolecularWeight: 328.90376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C[NH+]2CCN(CC2)CC3=CC=C(S3)Cl

Isomeric SMILES

CC1=NC(=CS1)C[NH+]2CCN(CC2)CC3=CC=C(S3)Cl

InChI

InChI=1S/C14H18ClN3S2/c1-11-16-12(10-19-11)8-17-4-6-18(7-5-17)9-13-2-3-14(15)20-13/h2-3,10H,4-9H2,1H3/p+1