N-[(2-fluorophenyl)methyl]-3-(2-methylpropyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[(2-fluorophenyl)methyl]-3-(2-methylpropyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[(2-fluorophenyl)methyl]-3-isobutyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[(2-fluorophenyl)methyl]-3-(2-methylpropyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[(2-fluorophenyl)methyl]-3-(2-methylpropyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(2-fluorobenzyl)-3-isobutyl-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C20H20FN3O2S MolecularWeight: 385.455103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC=CC=C3F)NC1=S

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC=CC=C3F)NC1=S

InChI

InChI=1S/C20H20FN3O2S/c1-12(2)11-24-19(26)15-8-7-13(9-17(15)23-20(24)27)18(25)22-10-14-5-3-4-6-16(14)21/h3-9,12H,10-11H2,1-2H3,(H,22,25)(H,23,27)