2-[3-[(2S)-butan-2-yl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-methoxy-5-methyl-phenyl)ethanamide

Systemtic Name: 2-[3-[(2S)-butan-2-yl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-methoxy-5-methyl-phenyl)ethanamide Openeye Name: N-(2-methoxy-5-methyl-phenyl)-2-[3-[(1S)-1-methylpropyl]-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: 2-[[3-[(2S)-butan-2-yl]-4-oxo-2-quinazolinyl]thio]-N-(2-methoxy-5-methylphenyl)acetamide IUPAC Name: 2-[3-[(2S)-butan-2-yl]-4-oxoquinazolin-2-yl]sulfanyl-N-(2-methoxy-5-methylphenyl)acetamide Traditional Name: 2-[[4-keto-3-[(1S)-1-methylpropyl]quinazolin-2-yl]thio]-N-(2-methoxy-5-methyl-phenyl)acetamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=CC(=C3)C)OC

Isomeric SMILES

CC[C@H](C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=CC(=C3)C)OC

InChI

InChI=1S/C22H25N3O3S/c1-5-15(3)25-21(27)16-8-6-7-9-17(16)24-22(25)29-13-20(26)23-18-12-14(2)10-11-19(18)28-4/h6-12,15H,5,13H2,1-4H3,(H,23,26)/t15-/m0/s1