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

Systemtic Name: (1S)-N-tert-butyl-1-(4-methoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Openeye Name: (1S)-N-tert-butyl-1-(4-methoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide CAS Name: (1S)-N-tert-butyl-1-(4-methoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide IUPAC Name: (1S)-N-tert-butyl-1-(4-methoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Traditional Name: (1S)-N-tert-butyl-1-(4-methoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Formula: C19H25N3OS MolecularWeight: 343.4863

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3OS/c1-19(2,3)20-18(24)22-13-12-21-11-5-6-16(21)17(22)14-7-9-15(23-4)10-8-14/h5-11,17H,12-13H2,1-4H3,(H,20,24)/t17-/m0/s1