2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)-N-[(4-propylphenyl)-thiophen-2-yl-methyl]ethanamide

Systemtic Name: 2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)-N-[(4-propylphenyl)-thiophen-2-yl-methyl]ethanamide Openeye Name: 2-(3-methyl-4-oxo-phthalazin-1-yl)-N-[(4-propylphenyl)-(2-thienyl)methyl]acetamide CAS Name: 2-(3-methyl-4-oxo-1-phthalazinyl)-N-[(4-propylphenyl)-thiophen-2-ylmethyl]acetamide IUPAC Name: 2-(3-methyl-4-oxophthalazin-1-yl)-N-[(4-propylphenyl)-thiophen-2-ylmethyl]acetamide Traditional Name: 2-(4-keto-3-methyl-phthalazin-1-yl)-N-[(4-propylphenyl)-(2-thienyl)methyl]acetamide Formula: C25H25N3O2S MolecularWeight: 431.5499

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CC3=NN(C(=O)C4=CC=CC=C43)C

Isomeric SMILES

CCCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CC3=NN(C(=O)C4=CC=CC=C43)C

InChI

InChI=1S/C25H25N3O2S/c1-3-7-17-11-13-18(14-12-17)24(22-10-6-15-31-22)26-23(29)16-21-19-8-4-5-9-20(19)25(30)28(2)27-21/h4-6,8-15,24H,3,7,16H2,1-2H3,(H,26,29)