4-[[4-(4-ethoxyphenyl)-3-prop-2-enyl-1,3-thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one bromide

Systemtic Name: 4-[[4-(4-ethoxyphenyl)-3-prop-2-enyl-1,3-thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one bromide Openeye Name: 4-[[3-allyl-4-(4-ethoxyphenyl)thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one bromide CAS Name: 4-[[4-(4-ethoxyphenyl)-3-prop-2-enyl-2-thiazolylidene]amino]-1,5-dimethyl-2-phenyl-3-pyrazolone bromide IUPAC Name: 4-[[4-(4-ethoxyphenyl)-3-prop-2-enyl-1,3-thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenylpyrazol-3-one bromide Traditional Name: 4-[(3-allyl-4-p-phenetyl-4-thiazolin-2-ylidene)amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one bromide Formula: C25H26BrN4O2S- MolecularWeight: 526.46854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)N2CC=C.[Br-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC(=NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)N2CC=C.[Br-]

InChI

InChI=1S/C25H26N4O2S.BrH/c1-5-16-28-22(19-12-14-21(15-13-19)31-6-2)17-32-25(28)26-23-18(3)27(4)29(24(23)30)20-10-8-7-9-11-20;/h5,7-15,17H,1,6,16H2,2-4H3;1H/p-1