2-ethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-oxidanylidene-5,6-diphenyl-pyridazine-4-carboxamide

Systemtic Name: 2-ethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-oxidanylidene-5,6-diphenyl-pyridazine-4-carboxamide Openeye Name: 2-ethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-oxo-5,6-diphenyl-pyridazine-4-carboxamide CAS Name: 2-ethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-oxo-5,6-diphenyl-4-pyridazinecarboxamide IUPAC Name: 2-ethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-oxo-5,6-diphenylpyridazine-4-carboxamide Traditional Name: 2-ethyl-3-keto-N-(6-mesyl-1,3-benzothiazol-2-yl)-5,6-diphenyl-pyridazine-4-carboxamide Formula: C27H22N4O4S2 MolecularWeight: 530.61798

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=C(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC4=NC5=C(S4)C=C(C=C5)S(=O)(=O)C

Isomeric SMILES

CCN1C(=O)C(=C(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC4=NC5=C(S4)C=C(C=C5)S(=O)(=O)C

InChI

InChI=1S/C27H22N4O4S2/c1-3-31-26(33)23(22(17-10-6-4-7-11-17)24(30-31)18-12-8-5-9-13-18)25(32)29-27-28-20-15-14-19(37(2,34)35)16-21(20)36-27/h4-16H,3H2,1-2H3,(H,28,29,32)