3-(4-methylpyridin-2-yl)-2-[(2S)-3-oxidanylidenebutan-2-yl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(4-methylpyridin-2-yl)-2-[(2S)-3-oxidanylidenebutan-2-yl]sulfanyl-quinazolin-4-one Openeye Name: 2-[(1S)-1-methyl-2-oxo-propyl]sulfanyl-3-(4-methyl-2-pyridyl)quinazolin-4-one CAS Name: 3-(4-methyl-2-pyridinyl)-2-[[(2S)-3-oxobutan-2-yl]thio]-4-quinazolinone IUPAC Name: 3-(4-methylpyridin-2-yl)-2-[(2S)-3-oxobutan-2-yl]sulfanylquinazolin-4-one Traditional Name: 2-[[(1S)-2-keto-1-methyl-propyl]thio]-3-(4-methyl-2-pyridyl)quinazolin-4-one Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)C

Isomeric SMILES

CC1=CC(=NC=C1)N2C(=O)C3=CC=CC=C3N=C2S[C@@H](C)C(=O)C

InChI

InChI=1S/C18H17N3O2S/c1-11-8-9-19-16(10-11)21-17(23)14-6-4-5-7-15(14)20-18(21)24-13(3)12(2)22/h4-10,13H,1-3H3/t13-/m0/s1