N-methyl-4-[[4-(4-prop-2-ynoxyphenyl)phthalazin-1-yl]amino]benzamide

Systemtic Name: N-methyl-4-[[4-(4-prop-2-ynoxyphenyl)phthalazin-1-yl]amino]benzamide Openeye Name: N-methyl-4-[[4-(4-prop-2-ynoxyphenyl)phthalazin-1-yl]amino]benzamide CAS Name: N-methyl-4-[[4-(4-prop-2-ynoxyphenyl)-1-phthalazinyl]amino]benzamide IUPAC Name: N-methyl-4-[[4-(4-prop-2-ynoxyphenyl)phthalazin-1-yl]amino]benzamide Traditional Name: N-methyl-4-[[4-(4-propargyloxyphenyl)phthalazin-1-yl]amino]benzamide Formula: C25H20N4O2 MolecularWeight: 408.4519

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)NC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)OCC#C

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)NC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)OCC#C

InChI

InChI=1S/C25H20N4O2/c1-3-16-31-20-14-10-17(11-15-20)23-21-6-4-5-7-22(21)24(29-28-23)27-19-12-8-18(9-13-19)25(30)26-2/h1,4-15H,16H2,2H3,(H,26,30)(H,27,29)