N-(6-ethoxy-1,3-benzothiazol-2-yl)-1-(4-methoxyphenyl)-4-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-1-(4-methoxyphenyl)-4-oxidanylidene-pyridazine-3-carboxamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-1-(4-methoxyphenyl)-4-oxo-pyridazine-3-carboxamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-1-(4-methoxyphenyl)-4-oxo-3-pyridazinecarboxamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-1-(4-methoxyphenyl)-4-oxopyridazine-3-carboxamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-keto-1-(4-methoxyphenyl)pyridazine-3-carboxamide Formula: C21H18N4O4S MolecularWeight: 422.45702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NN(C=CC3=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NN(C=CC3=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C21H18N4O4S/c1-3-29-15-8-9-16-18(12-15)30-21(22-16)23-20(27)19-17(26)10-11-25(24-19)13-4-6-14(28-2)7-5-13/h4-12H,3H2,1-2H3,(H,22,23,27)