2-[[(4S)-4-cyclopropyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[[(4S)-4-cyclopropyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[[(4S)-4-cyclopropyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[[(4S)-4-cyclopropyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[[(4S)-4-cyclopropyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[[(4S)-4-cyclopropyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methyl]-5-nitro-isoindoline-1,3-quinone Formula: C19H17N3O4S MolecularWeight: 383.42098

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2C3=C(CCN2CN4C(=O)C5=C(C4=O)C=C(C=C5)[N+](=O)[O-])SC=C3

Isomeric SMILES

C1CC1[C@H]2C3=C(CCN2CN4C(=O)C5=C(C4=O)C=C(C=C5)[N+](=O)[O-])SC=C3

InChI

InChI=1S/C19H17N3O4S/c23-18-13-4-3-12(22(25)26)9-15(13)19(24)21(18)10-20-7-5-16-14(6-8-27-16)17(20)11-1-2-11/h3-4,6,8-9,11,17H,1-2,5,7,10H2/t17-/m0/s1