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

Systemtic Name: 2-[3-[(2S)-butan-2-yl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-ethyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-N-ethyl-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-ethyl-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[3-[(2S)-butan-2-yl]-4-oxoquinazolin-2-yl]sulfanyl-N-ethylacetamide Traditional Name: N-benzyl-N-ethyl-2-[[4-keto-3-[(1S)-1-methylpropyl]quinazolin-2-yl]thio]acetamide Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O2S/c1-4-17(3)26-22(28)19-13-9-10-14-20(19)24-23(26)29-16-21(27)25(5-2)15-18-11-7-6-8-12-18/h6-14,17H,4-5,15-16H2,1-3H3/t17-/m0/s1