5-(4-methylpiperazin-4-ium-1-yl)-2-[(E)-2-thiophen-2-ylethenyl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-(4-methylpiperazin-4-ium-1-yl)-2-[(E)-2-thiophen-2-ylethenyl]-1,3-oxazole-4-carbonitrile Openeye Name: 5-(4-methylpiperazin-4-ium-1-yl)-2-[(E)-2-(2-thienyl)vinyl]oxazole-4-carbonitrile CAS Name: 5-(4-methyl-1-piperazin-4-iumyl)-2-[(E)-2-thiophen-2-ylethenyl]-4-oxazolecarbonitrile IUPAC Name: 5-(4-methylpiperazin-4-ium-1-yl)-2-[(E)-2-thiophen-2-ylethenyl]-1,3-oxazole-4-carbonitrile Traditional Name: 5-(4-methylpiperazin-4-ium-1-yl)-2-[(E)-2-(2-thienyl)vinyl]oxazole-4-carbonitrile Formula: C15H17N4OS+ MolecularWeight: 301.38668

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(N=C(O2)C=CC3=CC=CS3)C#N

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(N=C(O2)/C=C/C3=CC=CS3)C#N

InChI

InChI=1S/C15H16N4OS/c1-18-6-8-19(9-7-18)15-13(11-16)17-14(20-15)5-4-12-3-2-10-21-12/h2-5,10H,6-9H2,1H3/p+1/b5-4+