4-oxidanylidene-N-[4-(2,4,5-trimethylphenyl)-1,3-thiazol-2-yl]-3H-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-[4-(2,4,5-trimethylphenyl)-1,3-thiazol-2-yl]-3H-phthalazine-1-carboxamide Openeye Name: 4-oxo-N-[4-(2,4,5-trimethylphenyl)thiazol-2-yl]-3H-phthalazine-1-carboxamide CAS Name: 4-oxo-N-[4-(2,4,5-trimethylphenyl)-2-thiazolyl]-3H-phthalazine-1-carboxamide IUPAC Name: 4-oxo-N-[4-(2,4,5-trimethylphenyl)-1,3-thiazol-2-yl]-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[4-(2,4,5-trimethylphenyl)thiazol-2-yl]-3H-phthalazine-1-carboxamide Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=CSC(=N2)NC(=O)C3=NNC(=O)C4=CC=CC=C43)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C2=CSC(=N2)NC(=O)C3=NNC(=O)C4=CC=CC=C43)C)C

InChI

InChI=1S/C21H18N4O2S/c1-11-8-13(3)16(9-12(11)2)17-10-28-21(22-17)23-20(27)18-14-6-4-5-7-15(14)19(26)25-24-18/h4-10H,1-3H3,(H,25,26)(H,22,23,27)