1,3-benzothiazol-2-ylmethyl 6-oxidanylidene-1-propyl-pyridazine-3-carboxylate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 6-oxidanylidene-1-propyl-pyridazine-3-carboxylate Openeye Name: 1,3-benzothiazol-2-ylmethyl 6-oxo-1-propyl-pyridazine-3-carboxylate CAS Name: 6-oxo-1-propyl-3-pyridazinecarboxylic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 6-oxo-1-propylpyridazine-3-carboxylate Traditional Name: 6-keto-1-propyl-pyridazine-3-carboxylic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)OCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)OCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H15N3O3S/c1-2-9-19-15(20)8-7-12(18-19)16(21)22-10-14-17-11-5-3-4-6-13(11)23-14/h3-8H,2,9-10H2,1H3