2-azanyl-5-[[3-(4-methoxy-2-methyl-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-1,3-thiazol-4-one

Systemtic Name: 2-azanyl-5-[[3-(4-methoxy-2-methyl-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-1,3-thiazol-4-one Openeye Name: 2-amino-5-[[3-(4-methoxy-2-methyl-phenyl)-1-phenyl-pyrazol-4-yl]methylene]thiazol-4-one CAS Name: 2-amino-5-[[3-(4-methoxy-2-methylphenyl)-1-phenyl-4-pyrazolyl]methylidene]-4-thiazolone IUPAC Name: 2-amino-5-[[3-(4-methoxy-2-methylphenyl)-1-phenylpyrazol-4-yl]methylidene]-1,3-thiazol-4-one Traditional Name: 2-amino-5-[[3-(4-methoxy-2-methyl-phenyl)-1-phenyl-pyrazol-4-yl]methylene]-2-thiazolin-4-one Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)C2=NN(C=C2C=C3C(=O)N=C(S3)N)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)OC)C2=NN(C=C2C=C3C(=O)N=C(S3)N)C4=CC=CC=C4

InChI

InChI=1S/C21H18N4O2S/c1-13-10-16(27-2)8-9-17(13)19-14(11-18-20(26)23-21(22)28-18)12-25(24-19)15-6-4-3-5-7-15/h3-12H,1-2H3,(H2,22,23,26)