2-(4-bromophenyl)-N,N-dimethyl-4-(thiolan-3-ylmethyl)thieno[2,3-d]pyridazine-7-carboxamide

Systemtic Name: 2-(4-bromophenyl)-N,N-dimethyl-4-(thiolan-3-ylmethyl)thieno[2,3-d]pyridazine-7-carboxamide Openeye Name: 2-(4-bromophenyl)-N,N-dimethyl-4-(tetrahydrothiophen-3-ylmethyl)thieno[2,3-d]pyridazine-7-carboxamide CAS Name: 2-(4-bromophenyl)-N,N-dimethyl-4-(3-thiolanylmethyl)-7-thieno[2,3-d]pyridazinecarboxamide IUPAC Name: 2-(4-bromophenyl)-N,N-dimethyl-4-(thiolan-3-ylmethyl)thieno[2,3-d]pyridazine-7-carboxamide Traditional Name: 2-(4-bromophenyl)-N,N-dimethyl-4-(tetrahydrothiophen-3-ylmethyl)thieno[2,3-d]pyridazine-7-carboxamide Formula: C20H20BrN3OS2 MolecularWeight: 462.4263

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=NN=C(C2=C1SC(=C2)C3=CC=C(C=C3)Br)CC4CCSC4

Isomeric SMILES

CN(C)C(=O)C1=NN=C(C2=C1SC(=C2)C3=CC=C(C=C3)Br)CC4CCSC4

InChI

InChI=1S/C20H20BrN3OS2/c1-24(2)20(25)18-19-15(16(22-23-18)9-12-7-8-26-11-12)10-17(27-19)13-3-5-14(21)6-4-13/h3-6,10,12H,7-9,11H2,1-2H3