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

Systemtic Name: 2-azanyl-5-[[3-[4-(3-methylbutoxy)phenyl]-1-phenyl-pyrazol-4-yl]methylidene]-1,3-thiazol-4-one Openeye Name: 2-amino-5-[[3-(4-isopentyloxyphenyl)-1-phenyl-pyrazol-4-yl]methylene]thiazol-4-one CAS Name: 2-amino-5-[[3-[4-(3-methylbutoxy)phenyl]-1-phenyl-4-pyrazolyl]methylidene]-4-thiazolone IUPAC Name: 2-amino-5-[[3-[4-(3-methylbutoxy)phenyl]-1-phenylpyrazol-4-yl]methylidene]-1,3-thiazol-4-one Traditional Name: 2-amino-5-[[3-(4-isoamoxyphenyl)-1-phenyl-pyrazol-4-yl]methylene]-2-thiazolin-4-one Formula: C24H24N4O2S MolecularWeight: 432.53796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N=C(S3)N)C4=CC=CC=C4

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N=C(S3)N)C4=CC=CC=C4

InChI

InChI=1S/C24H24N4O2S/c1-16(2)12-13-30-20-10-8-17(9-11-20)22-18(14-21-23(29)26-24(25)31-21)15-28(27-22)19-6-4-3-5-7-19/h3-11,14-16H,12-13H2,1-2H3,(H2,25,26,29)