4-[(4Z)-4-[[5-(dimethylamino)furan-2-yl]methylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]benzenesulfonic acid

Systemtic Name: 4-[(4Z)-4-[[5-(dimethylamino)furan-2-yl]methylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]benzenesulfonic acid Openeye Name: 4-[(4Z)-4-[[5-(dimethylamino)-2-furyl]methylene]-3-methyl-5-oxo-pyrazol-1-yl]benzenesulfonic acid CAS Name: 4-[(4Z)-4-[[5-(dimethylamino)-2-furanyl]methylidene]-3-methyl-5-oxo-1-pyrazolyl]benzenesulfonic acid IUPAC Name: 4-[(4Z)-4-[[5-(dimethylamino)furan-2-yl]methylidene]-3-methyl-5-oxopyrazol-1-yl]benzenesulfonic acid Traditional Name: 4-[(4Z)-4-[[5-(dimethylamino)-2-furyl]methylene]-5-keto-3-methyl-2-pyrazolin-1-yl]besylic acid Formula: C17H17N3O5S MolecularWeight: 375.39898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=C(O2)N(C)C)C3=CC=C(C=C3)S(=O)(=O)O

Isomeric SMILES

CC\1=NN(C(=O)/C1=C\C2=CC=C(O2)N(C)C)C3=CC=C(C=C3)S(=O)(=O)O

InChI

InChI=1S/C17H17N3O5S/c1-11-15(10-13-6-9-16(25-13)19(2)3)17(21)20(18-11)12-4-7-14(8-5-12)26(22,23)24/h4-10H,1-3H3,(H,22,23,24)/b15-10-