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

Systemtic Name: 2-[3-[(2S)-butan-2-yl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-methylbutylcarbamoyl)ethanamide Openeye Name: N-(isopentylcarbamoyl)-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-[(3-methylbutylamino)-oxomethyl]acetamide IUPAC Name: 2-[3-[(2S)-butan-2-yl]-4-oxoquinazolin-2-yl]sulfanyl-N-(3-methylbutylcarbamoyl)acetamide Traditional Name: N-(isoamylcarbamoyl)-2-[[4-keto-3-[(1S)-1-methylpropyl]quinazolin-2-yl]thio]acetamide Formula: C20H28N4O3S MolecularWeight: 404.52632

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)NCCC(C)C

Isomeric SMILES

CC[C@H](C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)NCCC(C)C

InChI

InChI=1S/C20H28N4O3S/c1-5-14(4)24-18(26)15-8-6-7-9-16(15)22-20(24)28-12-17(25)23-19(27)21-11-10-13(2)3/h6-9,13-14H,5,10-12H2,1-4H3,(H2,21,23,25,27)/t14-/m0/s1