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

Systemtic Name: methyl N-[(4,5,6,7-tetradeuterio-1H-indol-3-yl)methyl]carbamodithioate Openeye Name: methyl N-[(4,5,6,7-tetradeuterio-1H-indol-3-yl)methyl]carbamodithioate CAS Name: N-[(4,5,6,7-tetradeuterio-1H-indol-3-yl)methyl]carbamodithioic acid methyl ester IUPAC Name: methyl N-[(4,5,6,7-tetradeuterio-1H-indol-3-yl)methyl]carbamodithioate Traditional Name: N-[(4,5,6,7-tetradeuterio-1H-indol-3-yl)methyl]carbamodithioic acid methyl ester Formula: C11H12N2S2 MolecularWeight: 240.381027

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC(=S)NCC1=CNC2=CC=CC=C21

Isomeric SMILES

[2H]C1=C(C(=C2C(=C1[2H])C(=CN2)CNC(=S)SC)[2H])[2H]

InChI

InChI=1S/C11H12N2S2/c1-15-11(14)13-7-8-6-12-10-5-3-2-4-9(8)10/h2-6,12H,7H2,1H3,(H,13,14)/i2D,3D,4D,5D