methyl (2E)-2-[3-[(6-chloranyl-4-oxidanidyl-quinoxalin-4-ium-2-yl)-methyl-amino]-1-methyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene]ethanoate

Systemtic Name: methyl (2E)-2-[3-[(6-chloranyl-4-oxidanidyl-quinoxalin-4-ium-2-yl)-methyl-amino]-1-methyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene]ethanoate Openeye Name: methyl (2E)-2-[3-[(6-chloro-4-oxido-quinoxalin-4-ium-2-yl)-methyl-amino]-1-methyl-5-oxo-2-thioxo-imidazolidin-4-ylidene]acetate CAS Name: (2E)-2-[3-[(6-chloro-4-oxido-2-quinoxalin-4-iumyl)-methylamino]-1-methyl-5-oxo-2-sulfanylidene-4-imidazolidinylidene]acetic acid methyl ester IUPAC Name: methyl (2E)-2-[3-[(6-chloro-4-oxidoquinoxalin-4-ium-2-yl)-methylamino]-1-methyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]acetate Traditional Name: (2E)-2-[3-[(6-chloro-4-oxido-quinoxalin-4-ium-2-yl)-methyl-amino]-5-keto-1-methyl-2-thioxo-imidazolidin-4-ylidene]acetic acid methyl ester Formula: C16H14ClN5O4S MolecularWeight: 407.83146

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC(=O)OC)N(C1=S)N(C)C2=C[N+](=C3C=C(C=CC3=N2)Cl)[O-]

Isomeric SMILES

CN1C(=O)/C(=C\C(=O)OC)/N(C1=S)N(C)C2=C[N+](=C3C=C(C=CC3=N2)Cl)[O-]

InChI

InChI=1S/C16H14ClN5O4S/c1-19-15(24)12(7-14(23)26-3)22(16(19)27)20(2)13-8-21(25)11-6-9(17)4-5-10(11)18-13/h4-8H,1-3H3/b12-7+