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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)F

Isomeric SMILES

CC(C(=O)NC1CCCC1)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)F

InChI

InChI=1S/C22H22FN3O2S/c1-14(20(27)24-16-6-2-3-7-16)29-22-25-19-9-5-4-8-18(19)21(28)26(22)17-12-10-15(23)11-13-17/h4-5,8-14,16H,2-3,6-7H2,1H3,(H,24,27)