N-methyl-2-[4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-phenyl-ethanamide

Systemtic Name: N-methyl-2-[4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-phenyl-ethanamide Openeye Name: N-methyl-2-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-phenyl-acetamide CAS Name: N-methyl-2-[[4-oxo-3-(2-oxolanylmethyl)-2-quinazolinyl]thio]-N-phenylacetamide IUPAC Name: N-methyl-2-[4-oxo-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-phenylacetamide Traditional Name: 2-[[4-keto-3-(tetrahydrofurfuryl)quinazolin-2-yl]thio]-N-methyl-N-phenyl-acetamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4CCCO4

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4CCCO4

InChI

InChI=1S/C22H23N3O3S/c1-24(16-8-3-2-4-9-16)20(26)15-29-22-23-19-12-6-5-11-18(19)21(27)25(22)14-17-10-7-13-28-17/h2-6,8-9,11-12,17H,7,10,13-15H2,1H3