2-[(2S)-1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-(3-methylpyridin-2-yl)quinazolin-4-one

Systemtic Name: 2-[(2S)-1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-(3-methylpyridin-2-yl)quinazolin-4-one Openeye Name: 2-[(1S)-2-(1H-indol-3-yl)-1-methyl-2-oxo-ethyl]sulfanyl-3-(3-methyl-2-pyridyl)quinazolin-4-one CAS Name: 2-[[(2S)-1-(1H-indol-3-yl)-1-oxopropan-2-yl]thio]-3-(3-methyl-2-pyridinyl)-4-quinazolinone IUPAC Name: 2-[(2S)-1-(1H-indol-3-yl)-1-oxopropan-2-yl]sulfanyl-3-(3-methylpyridin-2-yl)quinazolin-4-one Traditional Name: 2-[[(1S)-2-(1H-indol-3-yl)-2-keto-1-methyl-ethyl]thio]-3-(3-methyl-2-pyridyl)quinazolin-4-one Formula: C25H20N4O2S MolecularWeight: 440.5169

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)C4=CNC5=CC=CC=C54

Isomeric SMILES

CC1=C(N=CC=C1)N2C(=O)C3=CC=CC=C3N=C2S[C@@H](C)C(=O)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C25H20N4O2S/c1-15-8-7-13-26-23(15)29-24(31)18-10-4-6-12-21(18)28-25(29)32-16(2)22(30)19-14-27-20-11-5-3-9-17(19)20/h3-14,16,27H,1-2H3/t16-/m0/s1