(2R)-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[2-(4-fluorophenyl)ethyl]propanamide

Systemtic Name: (2R)-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[2-(4-fluorophenyl)ethyl]propanamide Openeye Name: (2R)-2-(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[2-(4-fluorophenyl)ethyl]propanamide CAS Name: (2R)-2-[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]-N-[2-(4-fluorophenyl)ethyl]propanamide IUPAC Name: (2R)-2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanyl-N-[2-(4-fluorophenyl)ethyl]propanamide Traditional Name: (2R)-2-[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]-N-[2-(4-fluorophenyl)ethyl]propionamide Formula: C22H22FN3O2S MolecularWeight: 411.492383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=C(C=C1)F)SC2=NC3=CC=CC=C3C(=O)N2C4CC4

Isomeric SMILES

C[C@H](C(=O)NCCC1=CC=C(C=C1)F)SC2=NC3=CC=CC=C3C(=O)N2C4CC4

InChI

InChI=1S/C22H22FN3O2S/c1-14(20(27)24-13-12-15-6-8-16(23)9-7-15)29-22-25-19-5-3-2-4-18(19)21(28)26(22)17-10-11-17/h2-9,14,17H,10-13H2,1H3,(H,24,27)/t14-/m1/s1