4-[[4-azanyl-2-(diethylamino)-6-methyl-pyrimidin-5-yl]diazenyl]-2,5-bis(chloranyl)benzenesulfonate

Systemtic Name: 4-[[4-azanyl-2-(diethylamino)-6-methyl-pyrimidin-5-yl]diazenyl]-2,5-bis(chloranyl)benzenesulfonate Openeye Name: 4-[4-amino-2-(diethylamino)-6-methyl-pyrimidin-5-yl]azo-2,5-dichloro-benzenesulfonate CAS Name: 4-[[4-amino-2-(diethylamino)-6-methyl-5-pyrimidinyl]azo]-2,5-dichlorobenzenesulfonate IUPAC Name: 4-[[4-amino-2-(diethylamino)-6-methylpyrimidin-5-yl]diazenyl]-2,5-dichlorobenzenesulfonate Traditional Name: 4-[4-amino-2-(diethylamino)-6-methyl-pyrimidin-5-yl]azo-2,5-dichloro-besylate Formula: C15H17Cl2N6O3S- MolecularWeight: 432.30488

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC(=C(C(=N1)N)N=NC2=CC(=C(C=C2Cl)S(=O)(=O)[O-])Cl)C

Isomeric SMILES

CCN(CC)C1=NC(=C(C(=N1)N)N=NC2=CC(=C(C=C2Cl)S(=O)(=O)[O-])Cl)C

InChI

InChI=1S/C15H18Cl2N6O3S/c1-4-23(5-2)15-19-8(3)13(14(18)20-15)22-21-11-6-10(17)12(7-9(11)16)27(24,25)26/h6-7H,4-5H2,1-3H3,(H2,18,19,20)(H,24,25,26)/p-1