2-oxidanylpropyl 3,4-dihydro-1H-isoquinoline-2-carbodithioate

Systemtic Name: 2-oxidanylpropyl 3,4-dihydro-1H-isoquinoline-2-carbodithioate Openeye Name: 2-hydroxypropyl 3,4-dihydro-1H-isoquinoline-2-carbodithioate CAS Name: 3,4-dihydro-1H-isoquinoline-2-carbodithioic acid 2-hydroxypropyl ester IUPAC Name: 2-hydroxypropyl 3,4-dihydro-1H-isoquinoline-2-carbodithioate Traditional Name: 3,4-dihydro-1H-isoquinoline-2-carbodithioic acid 2-hydroxypropyl ester Formula: C13H17NOS2 MolecularWeight: 267.41018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=S)N1CCC2=CC=CC=C2C1)O

Isomeric SMILES

CC(CSC(=S)N1CCC2=CC=CC=C2C1)O

InChI

InChI=1S/C13H17NOS2/c1-10(15)9-17-13(16)14-7-6-11-4-2-3-5-12(11)8-14/h2-5,10,15H,6-9H2,1H3