2-[3-[(2R)-butan-2-yl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-ethylphenyl)ethanamide

Systemtic Name: 2-[3-[(2R)-butan-2-yl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-ethylphenyl)ethanamide Openeye Name: N-(4-ethylphenyl)-2-[3-[(1R)-1-methylpropyl]-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: 2-[[3-[(2R)-butan-2-yl]-4-oxo-2-quinazolinyl]thio]-N-(4-ethylphenyl)acetamide IUPAC Name: 2-[3-[(2R)-butan-2-yl]-4-oxoquinazolin-2-yl]sulfanyl-N-(4-ethylphenyl)acetamide Traditional Name: N-(4-ethylphenyl)-2-[[4-keto-3-[(1R)-1-methylpropyl]quinazolin-2-yl]thio]acetamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C(C)CC

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2[C@H](C)CC

InChI

InChI=1S/C22H25N3O2S/c1-4-15(3)25-21(27)18-8-6-7-9-19(18)24-22(25)28-14-20(26)23-17-12-10-16(5-2)11-13-17/h6-13,15H,4-5,14H2,1-3H3,(H,23,26)/t15-/m1/s1