N-[2-methoxy-5-(3-methyl-4-oxidanylidene-phthalazin-1-yl)phenyl]thiophene-2-carboxamide

Systemtic Name: N-[2-methoxy-5-(3-methyl-4-oxidanylidene-phthalazin-1-yl)phenyl]thiophene-2-carboxamide Openeye Name: N-[2-methoxy-5-(3-methyl-4-oxo-phthalazin-1-yl)phenyl]thiophene-2-carboxamide CAS Name: N-[2-methoxy-5-(3-methyl-4-oxo-1-phthalazinyl)phenyl]-2-thiophenecarboxamide IUPAC Name: N-[2-methoxy-5-(3-methyl-4-oxophthalazin-1-yl)phenyl]thiophene-2-carboxamide Traditional Name: N-[5-(4-keto-3-methyl-phthalazin-1-yl)-2-methoxy-phenyl]thiophene-2-carboxamide Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C3=CC(=C(C=C3)OC)NC(=O)C4=CC=CS4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C3=CC(=C(C=C3)OC)NC(=O)C4=CC=CS4

InChI

InChI=1S/C21H17N3O3S/c1-24-21(26)15-7-4-3-6-14(15)19(23-24)13-9-10-17(27-2)16(12-13)22-20(25)18-8-5-11-28-18/h3-12H,1-2H3,(H,22,25)