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

Systemtic Name: 2-[(4-ethenylphenyl)methylsulfanyl]-3-(4-fluorophenyl)-N-methyl-4-oxidanylidene-N-(phenylmethyl)quinazoline-7-carboxamide Openeye Name: N-benzyl-3-(4-fluorophenyl)-N-methyl-4-oxo-2-[(4-vinylphenyl)methylsulfanyl]quinazoline-7-carboxamide CAS Name: 2-[(4-ethenylphenyl)methylthio]-3-(4-fluorophenyl)-N-methyl-4-oxo-N-(phenylmethyl)-7-quinazolinecarboxamide IUPAC Name: N-benzyl-2-[(4-ethenylphenyl)methylsulfanyl]-3-(4-fluorophenyl)-N-methyl-4-oxoquinazoline-7-carboxamide Traditional Name: N-benzyl-3-(4-fluorophenyl)-4-keto-N-methyl-2-[(4-vinylbenzyl)thio]quinazoline-7-carboxamide Formula: C32H26FN3O2S MolecularWeight: 535.631143

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC4=CC=C(C=C4)C=C)C5=CC=C(C=C5)F

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC4=CC=C(C=C4)C=C)C5=CC=C(C=C5)F

InChI

InChI=1S/C32H26FN3O2S/c1-3-22-9-11-24(12-10-22)21-39-32-34-29-19-25(30(37)35(2)20-23-7-5-4-6-8-23)13-18-28(29)31(38)36(32)27-16-14-26(33)15-17-27/h3-19H,1,20-21H2,2H3