N-[(4-chlorophenyl)methyl]-1-methyl-6-(oxan-4-ylmethyl)-4-oxidanylidene-thieno[2,3-c]pyridazine-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-1-methyl-6-(oxan-4-ylmethyl)-4-oxidanylidene-thieno[2,3-c]pyridazine-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-1-methyl-4-oxo-6-(tetrahydropyran-4-ylmethyl)thieno[2,3-c]pyridazine-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-1-methyl-6-(4-oxanylmethyl)-4-oxo-3-thieno[2,3-c]pyridazinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-1-methyl-6-(oxan-4-ylmethyl)-4-oxothieno[2,3-c]pyridazine-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-4-keto-1-methyl-6-(tetrahydropyran-4-ylmethyl)thieno[2,3-c]pyridazine-3-carboxamide Formula: C21H22ClN3O3S MolecularWeight: 431.93568

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(S2)CC3CCOCC3)C(=O)C(=N1)C(=O)NCC4=CC=C(C=C4)Cl

Isomeric SMILES

CN1C2=C(C=C(S2)CC3CCOCC3)C(=O)C(=N1)C(=O)NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H22ClN3O3S/c1-25-21-17(11-16(29-21)10-13-6-8-28-9-7-13)19(26)18(24-25)20(27)23-12-14-2-4-15(22)5-3-14/h2-5,11,13H,6-10,12H2,1H3,(H,23,27)