O-[N'-(1-adamantyl)carbamimidoyl] carbamothioate

Systemtic Name: O-[N'-(1-adamantyl)carbamimidoyl] carbamothioate Openeye Name: O-[N'-(1-adamantyl)carbamimidoyl] carbamothioate CAS Name: carbamothioic acid O-[1-adamantylimino(amino)methyl] ester IUPAC Name: O-[N'-(1-adamantyl)carbamimidoyl] carbamothioate Traditional Name: thiocarbamic acid O-[N'-(1-adamantyl)amidino] ester Formula: C12H19N3OS MolecularWeight: 253.36376

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)N=C(N)OC(=S)N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)N=C(N)OC(=S)N

InChI

InChI=1S/C12H19N3OS/c13-10(16-11(14)17)15-12-4-7-1-8(5-12)3-9(2-7)6-12/h7-9H,1-6H2,(H2,13,15)(H2,14,17)