trideuteriomethyl N-[(4,5,6,7-tetradeuterio-1-methoxy-indol-3-yl)methyl]carbamodithioate

Systemtic Name: trideuteriomethyl N-[(4,5,6,7-tetradeuterio-1-methoxy-indol-3-yl)methyl]carbamodithioate Openeye Name: trideuteriomethyl N-[(4,5,6,7-tetradeuterio-1-methoxy-indol-3-yl)methyl]carbamodithioate CAS Name: N-[(4,5,6,7-tetradeuterio-1-methoxy-3-indolyl)methyl]carbamodithioic acid trideuteriomethyl ester IUPAC Name: trideuteriomethyl N-[(4,5,6,7-tetradeuterio-1-methoxyindol-3-yl)methyl]carbamodithioate Traditional Name: N-[(4,5,6,7-tetradeuterio-1-methoxy-indol-3-yl)methyl]carbamodithioic acid trideuteriomethyl ester Formula: C12H14N2OS2 MolecularWeight: 273.425492

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Descriptors Computed from Structure

Canonical SMILES:

CON1C=C(C2=CC=CC=C21)CNC(=S)SC

Isomeric SMILES

[2H]C1=C(C(=C2C(=C1[2H])C(=CN2OC)CNC(=S)SC([2H])([2H])[2H])[2H])[2H]

InChI

InChI=1S/C12H14N2OS2/c1-15-14-8-9(7-13-12(16)17-2)10-5-3-4-6-11(10)14/h3-6,8H,7H2,1-2H3,(H,13,16)/i2D3,3D,4D,5D,6D