[(2R)-1-(1-adamantylcarbamoylamino)-1-oxidanylidene-propan-2-yl] N,N-diethylcarbamodithioate

Systemtic Name: [(2R)-1-(1-adamantylcarbamoylamino)-1-oxidanylidene-propan-2-yl] N,N-diethylcarbamodithioate Openeye Name: [(1R)-2-(1-adamantylcarbamoylamino)-1-methyl-2-oxo-ethyl] N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [(2R)-1-[[(1-adamantylamino)-oxomethyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(1-adamantylcarbamoylamino)-1-oxopropan-2-yl] N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid [(1R)-2-(1-adamantylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C19H31N3O2S2 MolecularWeight: 397.59834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SC(C)C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CCN(CC)C(=S)S[C@H](C)C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C19H31N3O2S2/c1-4-22(5-2)18(25)26-12(3)16(23)20-17(24)21-19-9-13-6-14(10-19)8-15(7-13)11-19/h12-15H,4-11H2,1-3H3,(H2,20,21,23,24)/t12-,13?,14?,15?,19?/m1/s1