N-[(2,3-dimethylphenyl)carbamoyl]-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide

Systemtic Name: N-[(2,3-dimethylphenyl)carbamoyl]-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide Openeye Name: N-[(2,3-dimethylphenyl)carbamoyl]-2-(4-phenylphthalazin-1-yl)sulfanyl-acetamide CAS Name: N-[(2,3-dimethylanilino)-oxomethyl]-2-[(4-phenyl-1-phthalazinyl)thio]acetamide IUPAC Name: N-[(2,3-dimethylphenyl)carbamoyl]-2-(4-phenylphthalazin-1-yl)sulfanylacetamide Traditional Name: N-[(2,3-dimethylphenyl)carbamoyl]-2-[(4-phenylphthalazin-1-yl)thio]acetamide Formula: C25H22N4O2S MolecularWeight: 442.53278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)NC(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)NC(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4)C

InChI

InChI=1S/C25H22N4O2S/c1-16-9-8-14-21(17(16)2)26-25(31)27-22(30)15-32-24-20-13-7-6-12-19(20)23(28-29-24)18-10-4-3-5-11-18/h3-14H,15H2,1-2H3,(H2,26,27,30,31)