N-[(2R)-1-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)butan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Systemtic Name: N-[(2R)-1-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)butan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-[(1R)-1-[[6-oxo-3-(2-thienyl)pyridazin-1-yl]methyl]propyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-[(2R)-1-(6-oxo-3-thiophen-2-yl-1-pyridazinyl)butan-2-yl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-[(2R)-1-(6-oxo-3-thiophen-2-ylpyridazin-1-yl)butan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-[(1R)-1-[[6-keto-3-(2-thienyl)pyridazin-1-yl]methyl]propyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN1C(=O)C=CC(=N1)C2=CC=CS2)NC(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC[C@H](CN1C(=O)C=CC(=N1)C2=CC=CS2)NC(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H21N3O4S/c1-2-15(13-24-20(25)8-6-16(23-24)19-4-3-11-29-19)22-21(26)14-5-7-17-18(12-14)28-10-9-27-17/h3-8,11-12,15H,2,9-10,13H2,1H3,(H,22,26)/t15-/m1/s1