2-[(4-ethenylphenyl)methylsulfanyl]-3-(3-fluorophenyl)-4-oxidanylidene-N-propan-2-yl-quinazoline-7-carboxamide

Systemtic Name: 2-[(4-ethenylphenyl)methylsulfanyl]-3-(3-fluorophenyl)-4-oxidanylidene-N-propan-2-yl-quinazoline-7-carboxamide Openeye Name: 3-(3-fluorophenyl)-N-isopropyl-4-oxo-2-[(4-vinylphenyl)methylsulfanyl]quinazoline-7-carboxamide CAS Name: 2-[(4-ethenylphenyl)methylthio]-3-(3-fluorophenyl)-4-oxo-N-propan-2-yl-7-quinazolinecarboxamide IUPAC Name: 2-[(4-ethenylphenyl)methylsulfanyl]-3-(3-fluorophenyl)-4-oxo-N-propan-2-ylquinazoline-7-carboxamide Traditional Name: 3-(3-fluorophenyl)-N-isopropyl-4-keto-2-[(4-vinylbenzyl)thio]quinazoline-7-carboxamide Formula: C27H24FN3O2S MolecularWeight: 473.561763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC3=CC=C(C=C3)C=C)C4=CC(=CC=C4)F

Isomeric SMILES

CC(C)NC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC3=CC=C(C=C3)C=C)C4=CC(=CC=C4)F

InChI

InChI=1S/C27H24FN3O2S/c1-4-18-8-10-19(11-9-18)16-34-27-30-24-14-20(25(32)29-17(2)3)12-13-23(24)26(33)31(27)22-7-5-6-21(28)15-22/h4-15,17H,1,16H2,2-3H3,(H,29,32)