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

Systemtic Name: (1R)-N-tert-butyl-1-(4-ethoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Openeye Name: (1R)-N-tert-butyl-1-(4-ethoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide CAS Name: (1R)-N-tert-butyl-1-(4-ethoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide IUPAC Name: (1R)-N-tert-butyl-1-(4-ethoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Traditional Name: (1R)-N-tert-butyl-1-p-phenetyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Formula: C20H27N3OS MolecularWeight: 357.51288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2C3=CC=CN3CCN2C(=S)NC(C)(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@@H]2C3=CC=CN3CCN2C(=S)NC(C)(C)C

InChI

InChI=1S/C20H27N3OS/c1-5-24-16-10-8-15(9-11-16)18-17-7-6-12-22(17)13-14-23(18)19(25)21-20(2,3)4/h6-12,18H,5,13-14H2,1-4H3,(H,21,25)/t18-/m1/s1