4-(4-chlorophenyl)-2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-1,3-thiazole

Systemtic Name: 4-(4-chlorophenyl)-2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-1,3-thiazole Openeye Name: 2-(4-benzhydrylpiperazin-4-ium-1-yl)-4-(4-chlorophenyl)thiazole CAS Name: 4-(4-chlorophenyl)-2-[4-(diphenylmethyl)-1-piperazin-4-iumyl]thiazole IUPAC Name: 2-(4-benzhydrylpiperazin-4-ium-1-yl)-4-(4-chlorophenyl)-1,3-thiazole Traditional Name: 2-(4-benzhydrylpiperazin-4-ium-1-yl)-4-(4-chlorophenyl)thiazole Formula: C26H25ClN3S+ MolecularWeight: 447.0148

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=NC(=CS4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=NC(=CS4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C26H24ClN3S/c27-23-13-11-20(12-14-23)24-19-31-26(28-24)30-17-15-29(16-18-30)25(21-7-3-1-4-8-21)22-9-5-2-6-10-22/h1-14,19,25H,15-18H2/p+1