5-(2,3-dimethoxy-6-methyl-7-nitro-quinoxalin-5-yl)-3H-1,3,4-thiadiazole-2-thione

Systemtic Name: 5-(2,3-dimethoxy-6-methyl-7-nitro-quinoxalin-5-yl)-3H-1,3,4-thiadiazole-2-thione Openeye Name: 5-(2,3-dimethoxy-6-methyl-7-nitro-quinoxalin-5-yl)-3H-1,3,4-thiadiazole-2-thione CAS Name: 5-(2,3-dimethoxy-6-methyl-7-nitro-5-quinoxalinyl)-3H-1,3,4-thiadiazole-2-thione IUPAC Name: 5-(2,3-dimethoxy-6-methyl-7-nitroquinoxalin-5-yl)-3H-1,3,4-thiadiazole-2-thione Traditional Name: 5-(2,3-dimethoxy-6-methyl-7-nitro-quinoxalin-5-yl)-3H-1,3,4-thiadiazole-2-thione Formula: C13H11N5O4S2 MolecularWeight: 365.38754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1C3=NNC(=S)S3)N=C(C(=N2)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C2C(=C1C3=NNC(=S)S3)N=C(C(=N2)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C13H11N5O4S2/c1-5-7(18(19)20)4-6-9(8(5)12-16-17-13(23)24-12)15-11(22-3)10(14-6)21-2/h4H,1-3H3,(H,17,23)