4-(4-nitrophenyl)-2-piperazin-4-ium-1-yl-1,3-thiazole

Systemtic Name: 4-(4-nitrophenyl)-2-piperazin-4-ium-1-yl-1,3-thiazole Openeye Name: 4-(4-nitrophenyl)-2-piperazin-4-ium-1-yl-thiazole CAS Name: 4-(4-nitrophenyl)-2-(1-piperazin-4-iumyl)thiazole IUPAC Name: 4-(4-nitrophenyl)-2-piperazin-4-ium-1-yl-1,3-thiazole Traditional Name: 4-(4-nitrophenyl)-2-piperazin-4-ium-1-yl-thiazole Formula: C13H15N4O2S+ MolecularWeight: 291.3488

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC[NH2+]1)C2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O2S/c18-17(19)11-3-1-10(2-4-11)12-9-20-13(15-12)16-7-5-14-6-8-16/h1-4,9,14H,5-8H2/p+1