3-(5-methylpyridin-2-yl)-2-(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)sulfanyl-quinazolin-4-one

Systemtic Name: 3-(5-methylpyridin-2-yl)-2-(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)sulfanyl-quinazolin-4-one Openeye Name: 2-(1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-3-(5-methyl-2-pyridyl)quinazolin-4-one CAS Name: 3-(5-methyl-2-pyridinyl)-2-[[1-oxo-1-(1-pyrrolidinyl)propan-2-yl]thio]-4-quinazolinone IUPAC Name: 3-(5-methylpyridin-2-yl)-2-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)sulfanylquinazolin-4-one Traditional Name: 2-[(2-keto-1-methyl-2-pyrrolidino-ethyl)thio]-3-(5-methyl-2-pyridyl)quinazolin-4-one Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)N4CCCC4

Isomeric SMILES

CC1=CN=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)N4CCCC4

InChI

InChI=1S/C21H22N4O2S/c1-14-9-10-18(22-13-14)25-20(27)16-7-3-4-8-17(16)23-21(25)28-15(2)19(26)24-11-5-6-12-24/h3-4,7-10,13,15H,5-6,11-12H2,1-2H3