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

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-5-methyl-4-[1-(thiophen-2-ylmethylamino)ethylidene]pyrazol-3-one Openeye Name: 2-(1,3-benzothiazol-2-yl)-5-methyl-4-[1-(2-thienylmethylamino)ethylidene]pyrazol-3-one CAS Name: 2-(1,3-benzothiazol-2-yl)-5-methyl-4-[1-(thiophen-2-ylmethylamino)ethylidene]-3-pyrazolone IUPAC Name: 2-(1,3-benzothiazol-2-yl)-5-methyl-4-[1-(thiophen-2-ylmethylamino)ethylidene]pyrazol-3-one Traditional Name: 2-(1,3-benzothiazol-2-yl)-5-methyl-4-[1-(2-thenylamino)ethylidene]-2-pyrazolin-3-one Formula: C18H16N4OS2 MolecularWeight: 368.47584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=C(C)NCC2=CC=CS2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=NN(C(=O)C1=C(C)NCC2=CC=CS2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H16N4OS2/c1-11(19-10-13-6-5-9-24-13)16-12(2)21-22(17(16)23)18-20-14-7-3-4-8-15(14)25-18/h3-9,19H,10H2,1-2H3