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

Systemtic Name: N-(4-ethanoylphenyl)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Openeye Name: N-(4-acetylphenyl)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide CAS Name: N-(4-acetylphenyl)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide IUPAC Name: N-(4-acetylphenyl)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Traditional Name: N-(4-acetylphenyl)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Formula: C17H19N3OS MolecularWeight: 313.41726

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC=CN2CCN1C(=S)NC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC1C2=CC=CN2CCN1C(=S)NC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C17H19N3OS/c1-12-16-4-3-9-19(16)10-11-20(12)17(22)18-15-7-5-14(6-8-15)13(2)21/h3-9,12H,10-11H2,1-2H3,(H,18,22)