N-ethyl-N-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-ethyl-N-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-ethyl-N-[[3-methoxy-4-(2-thienylmethoxy)phenyl]methyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-ethyl-N-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-ethyl-N-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-ethyl-4-keto-N-[3-methoxy-4-(2-thenyloxy)benzyl]-3-methyl-phthalazine-1-carboxamide Formula: C25H25N3O4S MolecularWeight: 463.5487

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OCC2=CC=CS2)OC)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OCC2=CC=CS2)OC)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C

InChI

InChI=1S/C25H25N3O4S/c1-4-28(25(30)23-19-9-5-6-10-20(19)24(29)27(2)26-23)15-17-11-12-21(22(14-17)31-3)32-16-18-8-7-13-33-18/h5-14H,4,15-16H2,1-3H3