(1R)-N-tert-butyl-1-(2,5-dimethoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide

Systemtic Name: (1R)-N-tert-butyl-1-(2,5-dimethoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Openeye Name: (1R)-N-tert-butyl-1-(2,5-dimethoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide CAS Name: (1R)-N-tert-butyl-1-(2,5-dimethoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide IUPAC Name: (1R)-N-tert-butyl-1-(2,5-dimethoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Traditional Name: (1R)-N-tert-butyl-1-(2,5-dimethoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Formula: C20H27N3O2S MolecularWeight: 373.51228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27N3O2S/c1-20(2,3)21-19(26)23-12-11-22-10-6-7-16(22)18(23)15-13-14(24-4)8-9-17(15)25-5/h6-10,13,18H,11-12H2,1-5H3,(H,21,26)/t18-/m1/s1