(4Z)-2-(1,3-benzothiazol-2-yl)-4-[(3,3-diphenylpropylamino)methylidene]-5-phenyl-pyrazol-3-one

Systemtic Name: (4Z)-2-(1,3-benzothiazol-2-yl)-4-[(3,3-diphenylpropylamino)methylidene]-5-phenyl-pyrazol-3-one Openeye Name: (4Z)-2-(1,3-benzothiazol-2-yl)-4-[(3,3-diphenylpropylamino)methylene]-5-phenyl-pyrazol-3-one CAS Name: (4Z)-2-(1,3-benzothiazol-2-yl)-4-[(3,3-diphenylpropylamino)methylidene]-5-phenyl-3-pyrazolone IUPAC Name: (4Z)-2-(1,3-benzothiazol-2-yl)-4-[(3,3-diphenylpropylamino)methylidene]-5-phenylpyrazol-3-one Traditional Name: (4Z)-2-(1,3-benzothiazol-2-yl)-4-[(3,3-diphenylpropylamino)methylene]-5-phenyl-2-pyrazolin-3-one Formula: C32H26N4OS MolecularWeight: 514.64004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=O)C2=CNCCC(C3=CC=CC=C3)C4=CC=CC=C4)C5=NC6=CC=CC=C6S5

Isomeric SMILES

C1=CC=C(C=C1)C\2=NN(C(=O)/C2=C\NCCC(C3=CC=CC=C3)C4=CC=CC=C4)C5=NC6=CC=CC=C6S5

InChI

InChI=1S/C32H26N4OS/c37-31-27(22-33-21-20-26(23-12-4-1-5-13-23)24-14-6-2-7-15-24)30(25-16-8-3-9-17-25)35-36(31)32-34-28-18-10-11-19-29(28)38-32/h1-19,22,26,33H,20-21H2/b27-22-