N-[(4-methylsulfonylphenyl)methyl]-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide

Systemtic Name: N-[(4-methylsulfonylphenyl)methyl]-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide Openeye Name: N-[(4-methylsulfonylphenyl)methyl]-6-oxo-1-propyl-pyridazine-3-carboxamide CAS Name: N-[(4-methylsulfonylphenyl)methyl]-6-oxo-1-propyl-3-pyridazinecarboxamide IUPAC Name: N-[(4-methylsulfonylphenyl)methyl]-6-oxo-1-propylpyridazine-3-carboxamide Traditional Name: 6-keto-N-(4-mesylbenzyl)-1-propyl-pyridazine-3-carboxamide Formula: C16H19N3O4S MolecularWeight: 349.40476

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C16H19N3O4S/c1-3-10-19-15(20)9-8-14(18-19)16(21)17-11-12-4-6-13(7-5-12)24(2,22)23/h4-9H,3,10-11H2,1-2H3,(H,17,21)