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

Systemtic Name: (1S)-N-(3-methoxyphenyl)-1-pyridin-3-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Openeye Name: (1S)-N-(3-methoxyphenyl)-1-(3-pyridyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide CAS Name: (1S)-N-(3-methoxyphenyl)-1-(3-pyridinyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide IUPAC Name: (1S)-N-(3-methoxyphenyl)-1-pyridin-3-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Traditional Name: (1S)-N-(3-methoxyphenyl)-1-(3-pyridyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Formula: C20H20N4OS MolecularWeight: 364.464

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)N2CCN3C=CC=C3C2C4=CN=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)N2CCN3C=CC=C3[C@@H]2C4=CN=CC=C4

InChI

InChI=1S/C20H20N4OS/c1-25-17-7-2-6-16(13-17)22-20(26)24-12-11-23-10-4-8-18(23)19(24)15-5-3-9-21-14-15/h2-10,13-14,19H,11-12H2,1H3,(H,22,26)/t19-/m0/s1