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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)CC1=CC(=CC=C1)F)SC2=NC3=CC=CC=C3C(=O)N2C4CC4

Isomeric SMILES

CC(C(=O)N(C)CC1=CC(=CC=C1)F)SC2=NC3=CC=CC=C3C(=O)N2C4CC4

InChI

InChI=1S/C22H22FN3O2S/c1-14(20(27)25(2)13-15-6-5-7-16(23)12-15)29-22-24-19-9-4-3-8-18(19)21(28)26(22)17-10-11-17/h3-9,12,14,17H,10-11,13H2,1-2H3