[2-(1-adamantylamino)-2-oxidanylidene-ethyl] carbamimidothioate hydrochloride

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl] carbamimidothioate hydrochloride Openeye Name: N-(1-adamantyl)-2-carbamimidoylsulfanyl-acetamide hydrochloride CAS Name: carbamimidothioic acid [2-(1-adamantylamino)-2-oxoethyl] ester hydrochloride IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl] carbamimidothioate hydrochloride Traditional Name: N-(1-adamantyl)-2-(amidinothio)acetamide hydrochloride Formula: C13H22ClN3OS MolecularWeight: 303.85128

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)CSC(=N)N.Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)CSC(=N)N.Cl

InChI

InChI=1S/C13H21N3OS.ClH/c14-12(15)18-7-11(17)16-13-4-8-1-9(5-13)3-10(2-8)6-13;/h8-10H,1-7H2,(H3,14,15)(H,16,17);1H