N-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide

Systemtic Name: N-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide Openeye Name: N-[4-[(3,5-dimethyl-1-piperidyl)sulfonyl]phenyl]-6-oxo-1-propyl-pyridazine-3-carboxamide CAS Name: N-[4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]phenyl]-6-oxo-1-propyl-3-pyridazinecarboxamide IUPAC Name: N-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]-6-oxo-1-propylpyridazine-3-carboxamide Traditional Name: N-[4-(3,5-dimethylpiperidino)sulfonylphenyl]-6-keto-1-propyl-pyridazine-3-carboxamide Formula: C21H28N4O4S MolecularWeight: 432.53642

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CC(CC(C3)C)C

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CC(CC(C3)C)C

InChI

InChI=1S/C21H28N4O4S/c1-4-11-25-20(26)10-9-19(23-25)21(27)22-17-5-7-18(8-6-17)30(28,29)24-13-15(2)12-16(3)14-24/h5-10,15-16H,4,11-14H2,1-3H3,(H,22,27)