3-(3,5-dimethoxyphenyl)-N,N-diethyl-2-[(2-fluorophenyl)methylsulfanyl]-4-oxidanylidene-quinazoline-7-carboxamide

Systemtic Name: 3-(3,5-dimethoxyphenyl)-N,N-diethyl-2-[(2-fluorophenyl)methylsulfanyl]-4-oxidanylidene-quinazoline-7-carboxamide Openeye Name: 3-(3,5-dimethoxyphenyl)-N,N-diethyl-2-[(2-fluorophenyl)methylsulfanyl]-4-oxo-quinazoline-7-carboxamide CAS Name: 3-(3,5-dimethoxyphenyl)-N,N-diethyl-2-[(2-fluorophenyl)methylthio]-4-oxo-7-quinazolinecarboxamide IUPAC Name: 3-(3,5-dimethoxyphenyl)-N,N-diethyl-2-[(2-fluorophenyl)methylsulfanyl]-4-oxoquinazoline-7-carboxamide Traditional Name: 3-(3,5-dimethoxyphenyl)-N,N-diethyl-2-[(2-fluorobenzyl)thio]-4-keto-quinazoline-7-carboxamide Formula: C28H28FN3O4S MolecularWeight: 521.603023

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC3=CC=CC=C3F)C4=CC(=CC(=C4)OC)OC

Isomeric SMILES

CCN(CC)C(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC3=CC=CC=C3F)C4=CC(=CC(=C4)OC)OC

InChI

InChI=1S/C28H28FN3O4S/c1-5-31(6-2)26(33)18-11-12-23-25(13-18)30-28(37-17-19-9-7-8-10-24(19)29)32(27(23)34)20-14-21(35-3)16-22(15-20)36-4/h7-16H,5-6,17H2,1-4H3