2-[2-(1-adamantyl)ethanoylamino]ethyl carbamimidothioate hydrobromide

Systemtic Name: 2-[2-(1-adamantyl)ethanoylamino]ethyl carbamimidothioate hydrobromide Openeye Name: 2-(1-adamantyl)-N-(2-carbamimidoylsulfanylethyl)acetamide hydrobromide CAS Name: carbamimidothioic acid 2-[[2-(1-adamantyl)-1-oxoethyl]amino]ethyl ester hydrobromide IUPAC Name: 2-[[2-(1-adamantyl)acetyl]amino]ethyl carbamimidothioate hydrobromide Traditional Name: 2-(1-adamantyl)-N-[2-(amidinothio)ethyl]acetamide hydrobromide Formula: C15H26BrN3OS MolecularWeight: 376.35544

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC(=O)NCCSC(=N)N.Br

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC(=O)NCCSC(=N)N.Br

InChI

InChI=1S/C15H25N3OS.BrH/c16-14(17)20-2-1-18-13(19)9-15-6-10-3-11(7-15)5-12(4-10)8-15;/h10-12H,1-9H2,(H3,16,17)(H,18,19);1H