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

Systemtic Name: 4-(4-methoxyphenyl)-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]-1,3-thiazole Openeye Name: 2-[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]-4-(4-methoxyphenyl)thiazole CAS Name: 4-(4-methoxyphenyl)-2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]thiazole IUPAC Name: 4-(4-methoxyphenyl)-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]-1,3-thiazole Traditional Name: 2-[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]-4-(4-methoxyphenyl)thiazole Formula: C23H26N3OS+ MolecularWeight: 392.53704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)N3CC[NH+](CC3)CC=CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)N3CC[NH+](CC3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C23H25N3OS/c1-27-21-11-9-20(10-12-21)22-18-28-23(24-22)26-16-14-25(15-17-26)13-5-8-19-6-3-2-4-7-19/h2-12,18H,13-17H2,1H3/p+1/b8-5+