N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide

Systemtic Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide Openeye Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide CAS Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-6-oxo-1-(2-phenoxyethyl)-3-pyridazinecarboxamide IUPAC Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide Traditional Name: 6-keto-N-[2-(methylthio)-1,3-benzothiazol-6-yl]-1-(2-phenoxyethyl)pyridazine-3-carboxamide Formula: C21H18N4O3S2 MolecularWeight: 438.52262

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=NN(C(=O)C=C3)CCOC4=CC=CC=C4

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=NN(C(=O)C=C3)CCOC4=CC=CC=C4

InChI

InChI=1S/C21H18N4O3S2/c1-29-21-23-16-8-7-14(13-18(16)30-21)22-20(27)17-9-10-19(26)25(24-17)11-12-28-15-5-3-2-4-6-15/h2-10,13H,11-12H2,1H3,(H,22,27)