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

Systemtic Name: 2-[3-[(2S)-butan-2-yl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-methyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-N-methyl-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-methyl-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[3-[(2S)-butan-2-yl]-4-oxoquinazolin-2-yl]sulfanyl-N-methylacetamide Traditional Name: N-benzyl-2-[[4-keto-3-[(1S)-1-methylpropyl]quinazolin-2-yl]thio]-N-methyl-acetamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C)CC3=CC=CC=C3

Isomeric SMILES

CC[C@H](C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C)CC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O2S/c1-4-16(2)25-21(27)18-12-8-9-13-19(18)23-22(25)28-15-20(26)24(3)14-17-10-6-5-7-11-17/h5-13,16H,4,14-15H2,1-3H3/t16-/m0/s1