N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide

Systemtic Name: N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide Openeye Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-6-oxo-1-propyl-pyridazine-3-carboxamide CAS Name: N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-6-oxo-1-propyl-3-pyridazinecarboxamide IUPAC Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-6-oxo-1-propylpyridazine-3-carboxamide Traditional Name: N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)-6-keto-1-propyl-pyridazine-3-carboxamide Formula: C18H21ClN4O4S MolecularWeight: 424.90174

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H21ClN4O4S/c1-2-9-23-17(24)8-7-15(21-23)18(25)20-13-5-6-14(19)16(12-13)28(26,27)22-10-3-4-11-22/h5-8,12H,2-4,9-11H2,1H3,(H,20,25)