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

Systemtic Name: 2-[3-(4-cyanophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-cyclopropyl-N-[(2-fluorophenyl)methyl]ethanamide Openeye Name: 2-[3-(4-cyanophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-cyclopropyl-N-[(2-fluorophenyl)methyl]acetamide CAS Name: 2-[[3-(4-cyanophenyl)-4-oxo-2-quinazolinyl]thio]-N-cyclopropyl-N-[(2-fluorophenyl)methyl]acetamide IUPAC Name: 2-[3-(4-cyanophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-cyclopropyl-N-[(2-fluorophenyl)methyl]acetamide Traditional Name: 2-[[3-(4-cyanophenyl)-4-keto-quinazolin-2-yl]thio]-N-cyclopropyl-N-(2-fluorobenzyl)acetamide Formula: C27H21FN4O2S MolecularWeight: 484.544643

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC=CC=C2F)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C#N

Isomeric SMILES

C1CC1N(CC2=CC=CC=C2F)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C#N

InChI

InChI=1S/C27H21FN4O2S/c28-23-7-3-1-5-19(23)16-31(20-13-14-20)25(33)17-35-27-30-24-8-4-2-6-22(24)26(34)32(27)21-11-9-18(15-29)10-12-21/h1-12,20H,13-14,16-17H2