3-(2-methoxyethyl)-2-[(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(2-methoxyethyl)-2-[(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(2-methoxyethyl)-2-[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(2-methoxyethyl)-2-[[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]thio]-4-quinazolinone IUPAC Name: 3-(2-methoxyethyl)-2-[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]sulfanylquinazolin-4-one Traditional Name: 2-[[(1R)-1-(4-keto-1H-quinazolin-2-yl)ethyl]thio]-3-(2-methoxyethyl)quinazolin-4-one Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)SC3=NC4=CC=CC=C4C(=O)N3CCOC

Isomeric SMILES

C[C@H](C1=NC(=O)C2=CC=CC=C2N1)SC3=NC4=CC=CC=C4C(=O)N3CCOC

InChI

InChI=1S/C21H20N4O3S/c1-13(18-22-16-9-5-3-7-14(16)19(26)24-18)29-21-23-17-10-6-4-8-15(17)20(27)25(21)11-12-28-2/h3-10,13H,11-12H2,1-2H3,(H,22,24,26)/t13-/m1/s1