(1S)-1-(2,5-dimethoxyphenyl)-N-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide

Systemtic Name: (1S)-1-(2,5-dimethoxyphenyl)-N-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Openeye Name: (1S)-1-(2,5-dimethoxyphenyl)-N-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide CAS Name: (1S)-1-(2,5-dimethoxyphenyl)-N-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide IUPAC Name: (1S)-1-(2,5-dimethoxyphenyl)-N-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Traditional Name: (1S)-1-(2,5-dimethoxyphenyl)-N-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N1CCN2C=CC=C2C1C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CNC(=S)N1CCN2C=CC=C2[C@@H]1C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C17H21N3O2S/c1-18-17(23)20-10-9-19-8-4-5-14(19)16(20)13-11-12(21-2)6-7-15(13)22-3/h4-8,11,16H,9-10H2,1-3H3,(H,18,23)/t16-/m0/s1