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

Systemtic Name: 3-(3,5-dimethoxyphenyl)-2-[(4-ethenylphenyl)methylsulfanyl]-N-(2-methylpropyl)-4-oxidanylidene-quinazoline-7-carboxamide Openeye Name: 3-(3,5-dimethoxyphenyl)-N-isobutyl-4-oxo-2-[(4-vinylphenyl)methylsulfanyl]quinazoline-7-carboxamide CAS Name: 3-(3,5-dimethoxyphenyl)-2-[(4-ethenylphenyl)methylthio]-N-(2-methylpropyl)-4-oxo-7-quinazolinecarboxamide IUPAC Name: 3-(3,5-dimethoxyphenyl)-2-[(4-ethenylphenyl)methylsulfanyl]-N-(2-methylpropyl)-4-oxoquinazoline-7-carboxamide Traditional Name: 3-(3,5-dimethoxyphenyl)-N-isobutyl-4-keto-2-[(4-vinylbenzyl)thio]quinazoline-7-carboxamide Formula: C30H31N3O4S MolecularWeight: 529.64984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC3=CC=C(C=C3)C=C)C4=CC(=CC(=C4)OC)OC

Isomeric SMILES

CC(C)CNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC3=CC=C(C=C3)C=C)C4=CC(=CC(=C4)OC)OC

InChI

InChI=1S/C30H31N3O4S/c1-6-20-7-9-21(10-8-20)18-38-30-32-27-13-22(28(34)31-17-19(2)3)11-12-26(27)29(35)33(30)23-14-24(36-4)16-25(15-23)37-5/h6-16,19H,1,17-18H2,2-5H3,(H,31,34)