4-azanyl-2-[(2E)-2-[1-(2-chloranyl-5-methyl-phenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]hydrazinyl]benzenesulfonic acid

Systemtic Name: 4-azanyl-2-[(2E)-2-[1-(2-chloranyl-5-methyl-phenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]hydrazinyl]benzenesulfonic acid Openeye Name: 4-amino-2-[(2E)-2-[1-(2-chloro-5-methyl-phenyl)-3-methyl-5-oxo-pyrazol-4-ylidene]hydrazino]benzenesulfonic acid CAS Name: 4-amino-2-[(2E)-2-[1-(2-chloro-5-methylphenyl)-3-methyl-5-oxo-4-pyrazolylidene]hydrazinyl]benzenesulfonic acid IUPAC Name: 4-amino-2-[(2E)-2-[1-(2-chloro-5-methylphenyl)-3-methyl-5-oxopyrazol-4-ylidene]hydrazinyl]benzenesulfonic acid Traditional Name: 4-amino-2-[(N'E)-N'-[1-(2-chloro-5-methyl-phenyl)-5-keto-3-methyl-2-pyrazolin-4-ylidene]hydrazino]besylic acid Formula: C17H16ClN5O4S MolecularWeight: 421.85804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)N2C(=O)C(=NNC3=C(C=CC(=C3)N)S(=O)(=O)O)C(=N2)C

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)N2C(=O)/C(=N/NC3=C(C=CC(=C3)N)S(=O)(=O)O)/C(=N2)C

InChI

InChI=1S/C17H16ClN5O4S/c1-9-3-5-12(18)14(7-9)23-17(24)16(10(2)22-23)21-20-13-8-11(19)4-6-15(13)28(25,26)27/h3-8,20H,19H2,1-2H3,(H,25,26,27)/b21-16+