[2-(2-aminocarbonyl-2,3-dihydro-1,4-benzoxazin-4-yl)-2-oxidanylidene-ethyl] pyrrolidine-1-carbodithioate

Systemtic Name: [2-(2-aminocarbonyl-2,3-dihydro-1,4-benzoxazin-4-yl)-2-oxidanylidene-ethyl] pyrrolidine-1-carbodithioate Openeye Name: [2-(2-carbamoyl-2,3-dihydro-1,4-benzoxazin-4-yl)-2-oxo-ethyl] pyrrolidine-1-carbodithioate CAS Name: 1-pyrrolidinecarbodithioic acid [2-(2-carbamoyl-2,3-dihydro-1,4-benzoxazin-4-yl)-2-oxoethyl] ester IUPAC Name: [2-(2-carbamoyl-2,3-dihydro-1,4-benzoxazin-4-yl)-2-oxoethyl] pyrrolidine-1-carbodithioate Traditional Name: pyrrolidine-1-carbodithioic acid [2-(2-carbamoyl-2,3-dihydro-1,4-benzoxazin-4-yl)-2-keto-ethyl] ester Formula: C16H19N3O3S2 MolecularWeight: 365.47036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=S)SCC(=O)N2CC(OC3=CC=CC=C32)C(=O)N

Isomeric SMILES

C1CCN(C1)C(=S)SCC(=O)N2CC(OC3=CC=CC=C32)C(=O)N

InChI

InChI=1S/C16H19N3O3S2/c17-15(21)13-9-19(11-5-1-2-6-12(11)22-13)14(20)10-24-16(23)18-7-3-4-8-18/h1-2,5-6,13H,3-4,7-10H2,(H2,17,21)