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

Systemtic Name: (5Z)-2-azanyl-5-[[1-phenyl-3-(4-prop-2-enoxyphenyl)pyrazol-4-yl]methylidene]-1,3-thiazol-4-one Openeye Name: (5Z)-5-[[3-(4-allyloxyphenyl)-1-phenyl-pyrazol-4-yl]methylene]-2-amino-thiazol-4-one CAS Name: (5Z)-2-amino-5-[[1-phenyl-3-(4-prop-2-enoxyphenyl)-4-pyrazolyl]methylidene]-4-thiazolone IUPAC Name: (5Z)-2-amino-5-[[1-phenyl-3-(4-prop-2-enoxyphenyl)pyrazol-4-yl]methylidene]-1,3-thiazol-4-one Traditional Name: (5Z)-5-[[3-(4-allyloxyphenyl)-1-phenyl-pyrazol-4-yl]methylene]-2-amino-2-thiazolin-4-one Formula: C22H18N4O2S MolecularWeight: 402.46892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C=CCOC1=CC=C(C=C1)C2=NN(C=C2/C=C\3/C(=O)N=C(S3)N)C4=CC=CC=C4

InChI

InChI=1S/C22H18N4O2S/c1-2-12-28-18-10-8-15(9-11-18)20-16(13-19-21(27)24-22(23)29-19)14-26(25-20)17-6-4-3-5-7-17/h2-11,13-14H,1,12H2,(H2,23,24,27)/b19-13-