2-(1,3-benzothiazol-2-yl)-5-propyl-4-[(thiophen-2-ylmethylamino)methylidene]pyrazol-3-one

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-5-propyl-4-[(thiophen-2-ylmethylamino)methylidene]pyrazol-3-one Openeye Name: 2-(1,3-benzothiazol-2-yl)-5-propyl-4-[(2-thienylmethylamino)methylene]pyrazol-3-one CAS Name: 2-(1,3-benzothiazol-2-yl)-5-propyl-4-[(thiophen-2-ylmethylamino)methylidene]-3-pyrazolone IUPAC Name: 2-(1,3-benzothiazol-2-yl)-5-propyl-4-[(thiophen-2-ylmethylamino)methylidene]pyrazol-3-one Traditional Name: 2-(1,3-benzothiazol-2-yl)-5-propyl-4-[(2-thenylamino)methylene]-2-pyrazolin-3-one Formula: C19H18N4OS2 MolecularWeight: 382.50242

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=CNCC2=CC=CS2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCC1=NN(C(=O)C1=CNCC2=CC=CS2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H18N4OS2/c1-2-6-15-14(12-20-11-13-7-5-10-25-13)18(24)23(22-15)19-21-16-8-3-4-9-17(16)26-19/h3-5,7-10,12,20H,2,6,11H2,1H3