2-cyclopropyl-5-[4-[(4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-4-ium-1-yl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-cyclopropyl-5-[4-[(4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-4-ium-1-yl]-1,3-oxazole-4-carbonitrile Openeye Name: 2-cyclopropyl-5-[4-[(4-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]piperazin-4-ium-1-yl]oxazole-4-carbonitrile CAS Name: 2-cyclopropyl-5-[4-[(4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-1-piperazin-4-iumyl]-4-oxazolecarbonitrile IUPAC Name: 2-cyclopropyl-5-[4-[(4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-4-ium-1-yl]-1,3-oxazole-4-carbonitrile Traditional Name: 2-cyclopropyl-5-[4-[(4-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]piperazin-4-ium-1-yl]oxazole-4-carbonitrile Formula: C15H20N7OS+ MolecularWeight: 346.4306

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN(C1=S)C[NH+]2CCN(CC2)C3=C(N=C(O3)C4CC4)C#N

Isomeric SMILES

CN1C=NN(C1=S)C[NH+]2CCN(CC2)C3=C(N=C(O3)C4CC4)C#N

InChI

InChI=1S/C15H19N7OS/c1-19-9-17-22(15(19)24)10-20-4-6-21(7-5-20)14-12(8-16)18-13(23-14)11-2-3-11/h9,11H,2-7,10H2,1H3/p+1