4-[[4-oxidanylidene-2-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanyl-quinazolin-3-yl]methyl]-N-(oxolan-2-ylmethyl)cyclohexane-1-carboxamide

Systemtic Name: 4-[[4-oxidanylidene-2-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanyl-quinazolin-3-yl]methyl]-N-(oxolan-2-ylmethyl)cyclohexane-1-carboxamide Openeye Name: 4-[[4-oxo-2-[2-oxo-2-(phenethylamino)ethyl]sulfanyl-quinazolin-3-yl]methyl]-N-(tetrahydrofuran-2-ylmethyl)cyclohexanecarboxamide CAS Name: N-(2-oxolanylmethyl)-4-[[4-oxo-2-[[2-oxo-2-(phenethylamino)ethyl]thio]-3-quinazolinyl]methyl]-1-cyclohexanecarboxamide IUPAC Name: N-(oxolan-2-ylmethyl)-4-[[4-oxo-2-[2-oxo-2-(phenethylamino)ethyl]sulfanylquinazolin-3-yl]methyl]cyclohexane-1-carboxamide Traditional Name: 4-[[4-keto-2-[[2-keto-2-(phenethylamino)ethyl]thio]quinazolin-3-yl]methyl]-N-(tetrahydrofurfuryl)cyclohexanecarboxamide Formula: C31H38N4O4S MolecularWeight: 562.72282

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2CCC(CC2)CN3C(=O)C4=CC=CC=C4N=C3SCC(=O)NCCC5=CC=CC=C5

Isomeric SMILES

C1CC(OC1)CNC(=O)C2CCC(CC2)CN3C(=O)C4=CC=CC=C4N=C3SCC(=O)NCCC5=CC=CC=C5

InChI

InChI=1S/C31H38N4O4S/c36-28(32-17-16-22-7-2-1-3-8-22)21-40-31-34-27-11-5-4-10-26(27)30(38)35(31)20-23-12-14-24(15-13-23)29(37)33-19-25-9-6-18-39-25/h1-5,7-8,10-11,23-25H,6,9,12-21H2,(H,32,36)(H,33,37)