[(2S)-1-[(3,4-dimethoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl] N,N-diethylcarbamodithioate

Systemtic Name: [(2S)-1-[(3,4-dimethoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl] N,N-diethylcarbamodithioate Openeye Name: [(1S)-2-[(3,4-dimethoxyphenyl)methylamino]-1-methyl-2-oxo-ethyl] N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [(2S)-1-[(3,4-dimethoxyphenyl)methylamino]-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-[(3,4-dimethoxyphenyl)methylamino]-1-oxopropan-2-yl] N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid [(1S)-2-keto-1-methyl-2-(veratrylamino)ethyl] ester Formula: C17H26N2O3S2 MolecularWeight: 370.52994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SC(C)C(=O)NCC1=CC(=C(C=C1)OC)OC

Isomeric SMILES

CCN(CC)C(=S)S[C@@H](C)C(=O)NCC1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C17H26N2O3S2/c1-6-19(7-2)17(23)24-12(3)16(20)18-11-13-8-9-14(21-4)15(10-13)22-5/h8-10,12H,6-7,11H2,1-5H3,(H,18,20)/t12-/m0/s1