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

Systemtic Name: (1S)-1-methyl-N-(4-nitrophenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Openeye Name: (1S)-1-methyl-N-(4-nitrophenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide CAS Name: (1S)-1-methyl-N-(4-nitrophenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide IUPAC Name: (1S)-1-methyl-N-(4-nitrophenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Traditional Name: (1S)-1-methyl-N-(4-nitrophenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Formula: C15H16N4O2S MolecularWeight: 316.37814

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC=CN2CCN1C(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1C2=CC=CN2CCN1C(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H16N4O2S/c1-11-14-3-2-8-17(14)9-10-18(11)15(22)16-12-4-6-13(7-5-12)19(20)21/h2-8,11H,9-10H2,1H3,(H,16,22)/t11-/m0/s1