2-(4-phenylphthalazin-1-yl)sulfanyl-1-(1,2,5-trimethylpyrrol-3-yl)ethanone

Systemtic Name: 2-(4-phenylphthalazin-1-yl)sulfanyl-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Openeye Name: 2-(4-phenylphthalazin-1-yl)sulfanyl-1-(1,2,5-trimethylpyrrol-3-yl)ethanone CAS Name: 2-[(4-phenyl-1-phthalazinyl)thio]-1-(1,2,5-trimethyl-3-pyrrolyl)ethanone IUPAC Name: 2-(4-phenylphthalazin-1-yl)sulfanyl-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Traditional Name: 2-[(4-phenylphthalazin-1-yl)thio]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Formula: C23H21N3OS MolecularWeight: 387.49734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(N1C)C)C(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C23H21N3OS/c1-15-13-20(16(2)26(15)3)21(27)14-28-23-19-12-8-7-11-18(19)22(24-25-23)17-9-5-4-6-10-17/h4-13H,14H2,1-3H3