N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[4-(3,4-dimethylphenyl)thiazol-2-yl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[4-(3,4-dimethylphenyl)-2-thiazolyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[4-(3,4-dimethylphenyl)thiazol-2-yl]-4-keto-3H-phthalazine-1-carboxamide Formula: C20H16N4O2S MolecularWeight: 376.43164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=NNC(=O)C4=CC=CC=C43)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=NNC(=O)C4=CC=CC=C43)C

InChI

InChI=1S/C20H16N4O2S/c1-11-7-8-13(9-12(11)2)16-10-27-20(21-16)22-19(26)17-14-5-3-4-6-15(14)18(25)24-23-17/h3-10H,1-2H3,(H,24,25)(H,21,22,26)