methyl N-[[6-methyl-7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]carbonylamino]carbamodithioate

Systemtic Name: methyl N-[[6-methyl-7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]carbonylamino]carbamodithioate Openeye Name: methyl N-[(6-methyl-7-nitro-2,3-dioxo-1,4-dihydroquinoxaline-5-carbonyl)amino]carbamodithioate CAS Name: N-[[(6-methyl-7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)-oxomethyl]amino]carbamodithioic acid methyl ester IUPAC Name: methyl N-[(6-methyl-7-nitro-2,3-dioxo-1,4-dihydroquinoxaline-5-carbonyl)amino]carbamodithioate Traditional Name: N-[(2,3-diketo-6-methyl-7-nitro-1,4-dihydroquinoxaline-5-carbonyl)amino]carbamodithioic acid methyl ester Formula: C12H11N5O5S2 MolecularWeight: 369.37624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1C(=O)NNC(=S)SC)NC(=O)C(=O)N2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C2C(=C1C(=O)NNC(=S)SC)NC(=O)C(=O)N2)[N+](=O)[O-]

InChI

InChI=1S/C12H11N5O5S2/c1-4-6(17(21)22)3-5-8(14-11(20)10(19)13-5)7(4)9(18)15-16-12(23)24-2/h3H,1-2H3,(H,13,19)(H,14,20)(H,15,18)(H,16,23)