(2Z)-2-[[3-(2-methyl-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one

Systemtic Name: (2Z)-2-[[3-(2-methyl-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one Openeye Name: (2Z)-2-[[3-(2-methyl-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylene]thiazolo[3,2-a]benzimidazol-1-one CAS Name: (2Z)-2-[[3-(2-methyl-4-propoxyphenyl)-1-phenyl-4-pyrazolyl]methylidene]-1-thiazolo[3,2-a]benzimidazolone IUPAC Name: (2Z)-2-[[3-(2-methyl-4-propoxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one Traditional Name: (2Z)-2-[[3-(2-methyl-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylene]thiazolo[3,2-a]benzimidazol-1-one Formula: C29H24N4O2S MolecularWeight: 492.59146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C5=CC=CC=C5N=C4S3)C6=CC=CC=C6)C

Isomeric SMILES

CCCOC1=CC(=C(C=C1)C2=NN(C=C2/C=C\3/C(=O)N4C5=CC=CC=C5N=C4S3)C6=CC=CC=C6)C

InChI

InChI=1S/C29H24N4O2S/c1-3-15-35-22-13-14-23(19(2)16-22)27-20(18-32(31-27)21-9-5-4-6-10-21)17-26-28(34)33-25-12-8-7-11-24(25)30-29(33)36-26/h4-14,16-18H,3,15H2,1-2H3/b26-17-