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

Systemtic Name: 2-(4-methyl-1-oxidanylidene-phthalazin-2-yl)-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]ethanamide Openeye Name: 2-(4-methyl-1-oxo-phthalazin-2-yl)-N-[2-(3-thienylmethylsulfanyl)phenyl]acetamide CAS Name: 2-(4-methyl-1-oxo-2-phthalazinyl)-N-[2-(3-thiophenylmethylthio)phenyl]acetamide IUPAC Name: 2-(4-methyl-1-oxophthalazin-2-yl)-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]acetamide Traditional Name: 2-(1-keto-4-methyl-phthalazin-2-yl)-N-[2-(3-thenylthio)phenyl]acetamide Formula: C22H19N3O2S2 MolecularWeight: 421.53516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)NC3=CC=CC=C3SCC4=CSC=C4

Isomeric SMILES

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)NC3=CC=CC=C3SCC4=CSC=C4

InChI

InChI=1S/C22H19N3O2S2/c1-15-17-6-2-3-7-18(17)22(27)25(24-15)12-21(26)23-19-8-4-5-9-20(19)29-14-16-10-11-28-13-16/h2-11,13H,12,14H2,1H3,(H,23,26)