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7-nitro-5-[(1,3-thiazol-2-ylamino)methyl]-1,4-dihydroquinoxaline-2,3-dione

7-nitro-5-[(1,3-thiazol-2-ylamino)methyl]-1,4-dihydroquinoxaline-2,3-dione

Systemtic Name:7-nitro-5-[(1,3-thiazol-2-ylamino)methyl]-1,4-dihydroquinoxaline-2,3-dione
Openeye Name:7-nitro-5-[(thiazol-2-ylamino)methyl]-1,4-dihydroquinoxaline-2,3-dione
CAS Name:7-nitro-5-[(2-thiazolylamino)methyl]-1,4-dihydroquinoxaline-2,3-dione
IUPAC Name:7-nitro-5-[(1,3-thiazol-2-ylamino)methyl]-1,4-dihydroquinoxaline-2,3-dione
Traditional Name:7-nitro-5-[(thiazol-2-ylamino)methyl]-1,4-dihydroquinoxaline-2,3-quinone
Formula: C12H9N5O4S
MolecularWeight: 319.29596
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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=N1)NCC2=CC(=CC3=C2NC(=O)C(=O)N3)[N+](=O)[O-]


Isomeric SMILES

C1=CSC(=N1)NCC2=CC(=CC3=C2NC(=O)C(=O)N3)[N+](=O)[O-]


InChI

InChI=1S/C12H9N5O4S/c18-10-11(19)16-9-6(5-14-12-13-1-2-22-12)3-7(17(20)21)4-8(9)15-10/h1-4H,5H2,(H,13,14)(H,15,18)(H,16,19)


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