5-methoxy-1-propan-2-ylsulfanyl-isoquinoline

Systemtic Name: 5-methoxy-1-propan-2-ylsulfanyl-isoquinoline Openeye Name: 1-isopropylsulfanyl-5-methoxy-isoquinoline CAS Name: 5-methoxy-1-(propan-2-ylthio)isoquinoline IUPAC Name: 5-methoxy-1-propan-2-ylsulfanylisoquinoline Traditional Name: 1-(isopropylthio)-5-methoxy-isoquinoline Formula: C13H15NOS MolecularWeight: 233.3293

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC=CC2=C1C=CC=C2OC

Isomeric SMILES

CC(C)SC1=NC=CC2=C1C=CC=C2OC

InChI

InChI=1S/C13H15NOS/c1-9(2)16-13-11-5-4-6-12(15-3)10(11)7-8-14-13/h4-9H,1-3H3