7-methyl-2-(2-phenylsulfanylethanoyl)-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-4-one

Systemtic Name: 7-methyl-2-(2-phenylsulfanylethanoyl)-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-4-one Openeye Name: 7-methyl-2-(2-phenylsulfanylacetyl)-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-4-one CAS Name: 7-methyl-2-[1-oxo-2-(phenylthio)ethyl]-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-4-one IUPAC Name: 7-methyl-2-(2-phenylsulfanylacetyl)-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-4-one Traditional Name: 7-methyl-2-[2-(phenylthio)acetyl]-3,6,7,11b-tetrahydro-1H-pyrazin[2,1-a]isoquinolin-4-one Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN2C(CN(CC2=O)C(=O)CSC3=CC=CC=C3)C4=CC=CC=C14

Isomeric SMILES

CC1CN2C(CN(CC2=O)C(=O)CSC3=CC=CC=C3)C4=CC=CC=C14

InChI

InChI=1S/C21H22N2O2S/c1-15-11-23-19(18-10-6-5-9-17(15)18)12-22(13-20(23)24)21(25)14-26-16-7-3-2-4-8-16/h2-10,15,19H,11-14H2,1H3