1-(2-methyl-2,3-dihydroindol-1-yl)-2-(4-phenylazanylquinazolin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(2-methyl-2,3-dihydroindol-1-yl)-2-(4-phenylazanylquinazolin-2-yl)sulfanyl-ethanone Openeye Name: 2-(4-anilinoquinazolin-2-yl)sulfanyl-1-(2-methylindolin-1-yl)ethanone CAS Name: 2-[(4-anilino-2-quinazolinyl)thio]-1-(2-methyl-2,3-dihydroindol-1-yl)ethanone IUPAC Name: 2-(4-anilinoquinazolin-2-yl)sulfanyl-1-(2-methyl-2,3-dihydroindol-1-yl)ethanone Traditional Name: 2-[(4-anilinoquinazolin-2-yl)thio]-1-(2-methylindolin-1-yl)ethanone Formula: C25H22N4OS MolecularWeight: 426.53338

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)CSC3=NC4=CC=CC=C4C(=N3)NC5=CC=CC=C5

Isomeric SMILES

CC1CC2=CC=CC=C2N1C(=O)CSC3=NC4=CC=CC=C4C(=N3)NC5=CC=CC=C5

InChI

InChI=1S/C25H22N4OS/c1-17-15-18-9-5-8-14-22(18)29(17)23(30)16-31-25-27-21-13-7-6-12-20(21)24(28-25)26-19-10-3-2-4-11-19/h2-14,17H,15-16H2,1H3,(H,26,27,28)