1-[1-azanyl-5-(furan-2-ylmethyl)nonan-2-yl]thiourea dihydrobromide

Systemtic Name: 1-[1-azanyl-5-(furan-2-ylmethyl)nonan-2-yl]thiourea dihydrobromide Openeye Name: [1-(aminomethyl)-4-(2-furylmethyl)octyl]thiourea dihydrobromide CAS Name: [1-amino-5-(2-furanylmethyl)nonan-2-yl]thiourea dihydrobromide IUPAC Name: [1-amino-5-(furan-2-ylmethyl)nonan-2-yl]thiourea dihydrobromide Traditional Name: [1-(aminomethyl)-4-(2-furfuryl)octyl]thiourea dihydrobromide Formula: C15H29Br2N3OS MolecularWeight: 459.28326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC(CN)NC(=S)N)CC1=CC=CO1.Br.Br

Isomeric SMILES

CCCCC(CCC(CN)NC(=S)N)CC1=CC=CO1.Br.Br

InChI

InChI=1S/C15H27N3OS.2BrH/c1-2-3-5-12(10-14-6-4-9-19-14)7-8-13(11-16)18-15(17)20;;/h4,6,9,12-13H,2-3,5,7-8,10-11,16H2,1H3,(H3,17,18,20);2*1H