1-but-3-enyl-N-(furan-2-ylmethyl)-3-oxidanidyl-3-(5-pentyl-1,3,4-thiadiazol-2-yl)imidazolidin-3-ium-4-amine

Systemtic Name: 1-but-3-enyl-N-(furan-2-ylmethyl)-3-oxidanidyl-3-(5-pentyl-1,3,4-thiadiazol-2-yl)imidazolidin-3-ium-4-amine Openeye Name: 1-but-3-enyl-N-(2-furylmethyl)-3-oxido-3-(5-pentyl-1,3,4-thiadiazol-2-yl)imidazolidin-3-ium-4-amine CAS Name: 1-but-3-enyl-N-(2-furanylmethyl)-3-oxido-3-(5-pentyl-1,3,4-thiadiazol-2-yl)-4-imidazolidin-3-iumamine IUPAC Name: 1-but-3-enyl-N-(furan-2-ylmethyl)-3-oxido-3-(5-pentyl-1,3,4-thiadiazol-2-yl)imidazolidin-3-ium-4-amine Traditional Name: [3-(5-amyl-1,3,4-thiadiazol-2-yl)-1-but-3-enyl-3-oxido-imidazolidin-3-ium-4-yl]-(2-furfuryl)amine Formula: C19H29N5O2S MolecularWeight: 391.53086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)[N+]2(CN(CC2NCC3=CC=CO3)CCC=C)[O-]

Isomeric SMILES

CCCCCC1=NN=C(S1)[N+]2(CN(CC2NCC3=CC=CO3)CCC=C)[O-]

InChI

InChI=1S/C19H29N5O2S/c1-3-5-7-10-18-21-22-19(27-18)24(25)15-23(11-6-4-2)14-17(24)20-13-16-9-8-12-26-16/h4,8-9,12,17,20H,2-3,5-7,10-11,13-15H2,1H3