N-[(4-methoxyphenyl)methyl]-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide

Systemtic Name: N-[(4-methoxyphenyl)methyl]-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Openeye Name: N-[(4-methoxyphenyl)methyl]-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide CAS Name: N-[(4-methoxyphenyl)methyl]-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Traditional Name: 1-methyl-N-p-anisyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Formula: C17H21N3OS MolecularWeight: 315.43314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC=CN2CCN1C(=S)NCC3=CC=C(C=C3)OC

Isomeric SMILES

CC1C2=CC=CN2CCN1C(=S)NCC3=CC=C(C=C3)OC

InChI

InChI=1S/C17H21N3OS/c1-13-16-4-3-9-19(16)10-11-20(13)17(22)18-12-14-5-7-15(21-2)8-6-14/h3-9,13H,10-12H2,1-2H3,(H,18,22)