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

Systemtic Name: 2-[3-[(2S)-butan-2-yl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(furan-2-ylmethylcarbamoyl)ethanamide Openeye Name: N-(2-furylmethylcarbamoyl)-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-furanylmethylamino)-oxomethyl]acetamide IUPAC Name: 2-[3-[(2S)-butan-2-yl]-4-oxoquinazolin-2-yl]sulfanyl-N-(furan-2-ylmethylcarbamoyl)acetamide Traditional Name: N-(2-furfurylcarbamoyl)-2-[[4-keto-3-[(1S)-1-methylpropyl]quinazolin-2-yl]thio]acetamide Formula: C20H22N4O4S MolecularWeight: 414.47808

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)NCC3=CC=CO3

Isomeric SMILES

CC[C@H](C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)NCC3=CC=CO3

InChI

InChI=1S/C20H22N4O4S/c1-3-13(2)24-18(26)15-8-4-5-9-16(15)22-20(24)29-12-17(25)23-19(27)21-11-14-7-6-10-28-14/h4-10,13H,3,11-12H2,1-2H3,(H2,21,23,25,27)/t13-/m0/s1