2-(1,3-benzothiazol-2-yl)-4-[1-[(3-fluorophenyl)amino]ethylidene]-5-propylidene-pyrazolidin-3-one

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-4-[1-[(3-fluorophenyl)amino]ethylidene]-5-propylidene-pyrazolidin-3-one Openeye Name: 2-(1,3-benzothiazol-2-yl)-4-[1-(3-fluoroanilino)ethylidene]-5-propylidene-pyrazolidin-3-one CAS Name: 2-(1,3-benzothiazol-2-yl)-4-[1-(3-fluoroanilino)ethylidene]-5-propylidene-3-pyrazolidinone IUPAC Name: 2-(1,3-benzothiazol-2-yl)-4-[1-(3-fluoroanilino)ethylidene]-5-propylidenepyrazolidin-3-one Traditional Name: 2-(1,3-benzothiazol-2-yl)-4-[1-(3-fluoroanilino)ethylidene]-5-propylidene-pyrazolidin-3-one Formula: C21H19FN4OS MolecularWeight: 394.465163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC=C1C(=C(C)NC2=CC(=CC=C2)F)C(=O)N(N1)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCC=C1C(=C(C)NC2=CC(=CC=C2)F)C(=O)N(N1)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H19FN4OS/c1-3-7-17-19(13(2)23-15-9-6-8-14(22)12-15)20(27)26(25-17)21-24-16-10-4-5-11-18(16)28-21/h4-12,23,25H,3H2,1-2H3