cyclopropyl-[[4-ethyl-3-(furan-2-yl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-(4-methylcyclohexyl)azanium

Systemtic Name: cyclopropyl-[[4-ethyl-3-(furan-2-yl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-(4-methylcyclohexyl)azanium Openeye Name: cyclopropyl-[[4-ethyl-3-(2-furyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]-(4-methylcyclohexyl)ammonium CAS Name: cyclopropyl-[[4-ethyl-3-(2-furanyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-(4-methylcyclohexyl)ammonium IUPAC Name: cyclopropyl-[[4-ethyl-3-(furan-2-yl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-(4-methylcyclohexyl)azanium Traditional Name: cyclopropyl-[[4-ethyl-3-(2-furyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]-(4-methylcyclohexyl)ammonium Formula: C19H29N4OS+ MolecularWeight: 361.52476

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)C[NH+](C2CCC(CC2)C)C3CC3)C4=CC=CO4

Isomeric SMILES

CCN1C(=NN(C1=S)C[NH+](C2CCC(CC2)C)C3CC3)C4=CC=CO4

InChI

InChI=1S/C19H28N4OS/c1-3-21-18(17-5-4-12-24-17)20-23(19(21)25)13-22(16-10-11-16)15-8-6-14(2)7-9-15/h4-5,12,14-16H,3,6-11,13H2,1-2H3/p+1