2-phenyl-4-[[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methyl]-1,3-thiazole

Systemtic Name: 2-phenyl-4-[[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methyl]-1,3-thiazole Openeye Name: 4-[[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]methyl]-2-phenyl-thiazole CAS Name: 2-phenyl-4-[[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]methyl]thiazole IUPAC Name: 2-phenyl-4-[[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methyl]-1,3-thiazole Traditional Name: 4-[[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]methyl]-2-phenyl-thiazole Formula: C23H26N3S+ MolecularWeight: 376.53764

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC=CC2=CC=CC=C2)CC3=CSC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1C/C=C/C2=CC=CC=C2)CC3=CSC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3S/c1-3-8-20(9-4-1)10-7-13-25-14-16-26(17-15-25)18-22-19-27-23(24-22)21-11-5-2-6-12-21/h1-12,19H,13-18H2/p+1/b10-7+