2-(furan-2-yl)-5-[4-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]piperazin-4-ium-1-yl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-(furan-2-yl)-5-[4-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]piperazin-4-ium-1-yl]-1,3-oxazole-4-carbonitrile Openeye Name: 2-(2-furyl)-5-[4-[[5-methyl-2-(2-thienyl)oxazol-4-yl]methyl]piperazin-4-ium-1-yl]oxazole-4-carbonitrile CAS Name: 2-(2-furanyl)-5-[4-[(5-methyl-2-thiophen-2-yl-4-oxazolyl)methyl]-1-piperazin-4-iumyl]-4-oxazolecarbonitrile IUPAC Name: 2-(furan-2-yl)-5-[4-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]piperazin-4-ium-1-yl]-1,3-oxazole-4-carbonitrile Traditional Name: 2-(2-furyl)-5-[4-[[5-methyl-2-(2-thienyl)oxazol-4-yl]methyl]piperazin-4-ium-1-yl]oxazole-4-carbonitrile Formula: C21H20N5O3S+ MolecularWeight: 422.4802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CS2)C[NH+]3CCN(CC3)C4=C(N=C(O4)C5=CC=CO5)C#N

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CS2)C[NH+]3CCN(CC3)C4=C(N=C(O4)C5=CC=CO5)C#N

InChI

InChI=1S/C21H19N5O3S/c1-14-16(24-20(28-14)18-5-3-11-30-18)13-25-6-8-26(9-7-25)21-15(12-22)23-19(29-21)17-4-2-10-27-17/h2-5,10-11H,6-9,13H2,1H3/p+1