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

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxamide Openeye Name: 1-benzyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-6-oxo-pyridazine-3-carboxamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-6-oxo-1-(phenylmethyl)-3-pyridazinecarboxamide IUPAC Name: 1-benzyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-6-oxopyridazine-3-carboxamide Traditional Name: 1-benzyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-6-keto-pyridazine-3-carboxamide Formula: C21H18N4O3S MolecularWeight: 406.45762

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NN(C(=O)C=C3)CC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NN(C(=O)C=C3)CC4=CC=CC=C4

InChI

InChI=1S/C21H18N4O3S/c1-2-28-15-8-9-16-18(12-15)29-21(22-16)23-20(27)17-10-11-19(26)25(24-17)13-14-6-4-3-5-7-14/h3-12H,2,13H2,1H3,(H,22,23,27)