N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C19H16N4O3S MolecularWeight: 380.42034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C

InChI

InChI=1S/C19H16N4O3S/c1-3-26-11-8-9-14-15(10-11)27-19(20-14)21-17(24)16-12-6-4-5-7-13(12)18(25)23(2)22-16/h4-10H,3H2,1-2H3,(H,20,21,24)