2-[4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-quinolin-5-yl-propanamide

Systemtic Name: 2-[4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-quinolin-5-yl-propanamide Openeye Name: 2-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-(5-quinolyl)propanamide CAS Name: 2-[[4-oxo-3-(2-oxolanylmethyl)-2-quinazolinyl]thio]-N-(5-quinolinyl)propanamide IUPAC Name: 2-[4-oxo-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-quinolin-5-ylpropanamide Traditional Name: 2-[[4-keto-3-(tetrahydrofurfuryl)quinazolin-2-yl]thio]-N-(5-quinolyl)propionamide Formula: C25H24N4O3S MolecularWeight: 460.54806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=C1C=CC=N2)SC3=NC4=CC=CC=C4C(=O)N3CC5CCCO5

Isomeric SMILES

CC(C(=O)NC1=CC=CC2=C1C=CC=N2)SC3=NC4=CC=CC=C4C(=O)N3CC5CCCO5

InChI

InChI=1S/C25H24N4O3S/c1-16(23(30)27-21-12-4-11-20-18(21)9-5-13-26-20)33-25-28-22-10-3-2-8-19(22)24(31)29(25)15-17-7-6-14-32-17/h2-5,8-13,16-17H,6-7,14-15H2,1H3,(H,27,30)