N-(3-methylphenyl)-N-[4-[(4-phenylphthalazin-1-yl)sulfanylmethyl]-1,3-thiazol-2-yl]ethanamide

Systemtic Name: N-(3-methylphenyl)-N-[4-[(4-phenylphthalazin-1-yl)sulfanylmethyl]-1,3-thiazol-2-yl]ethanamide Openeye Name: N-(m-tolyl)-N-[4-[(4-phenylphthalazin-1-yl)sulfanylmethyl]thiazol-2-yl]acetamide CAS Name: N-(3-methylphenyl)-N-[4-[[(4-phenyl-1-phthalazinyl)thio]methyl]-2-thiazolyl]acetamide IUPAC Name: N-(3-methylphenyl)-N-[4-[(4-phenylphthalazin-1-yl)sulfanylmethyl]-1,3-thiazol-2-yl]acetamide Traditional Name: N-(m-tolyl)-N-[4-[[(4-phenylphthalazin-1-yl)thio]methyl]thiazol-2-yl]acetamide Formula: C27H22N4OS2 MolecularWeight: 482.61978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(C2=NC(=CS2)CSC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5)C(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N(C2=NC(=CS2)CSC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5)C(=O)C

InChI

InChI=1S/C27H22N4OS2/c1-18-9-8-12-22(15-18)31(19(2)32)27-28-21(17-34-27)16-33-26-24-14-7-6-13-23(24)25(29-30-26)20-10-4-3-5-11-20/h3-15,17H,16H2,1-2H3