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

Systemtic Name: 3-(3,5-dimethoxyphenyl)-N,N-diethyl-2-[(4-methylphenyl)methylsulfanyl]-4-oxidanylidene-quinazoline-7-carboxamide Openeye Name: 3-(3,5-dimethoxyphenyl)-N,N-diethyl-4-oxo-2-(p-tolylmethylsulfanyl)quinazoline-7-carboxamide CAS Name: 3-(3,5-dimethoxyphenyl)-N,N-diethyl-2-[(4-methylphenyl)methylthio]-4-oxo-7-quinazolinecarboxamide IUPAC Name: 3-(3,5-dimethoxyphenyl)-N,N-diethyl-2-[(4-methylphenyl)methylsulfanyl]-4-oxoquinazoline-7-carboxamide Traditional Name: 3-(3,5-dimethoxyphenyl)-N,N-diethyl-4-keto-2-[(4-methylbenzyl)thio]quinazoline-7-carboxamide Formula: C29H31N3O4S MolecularWeight: 517.63914

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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=C(C=C3)C)C4=CC(=CC(=C4)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C29H31N3O4S/c1-6-31(7-2)27(33)21-12-13-25-26(14-21)30-29(37-18-20-10-8-19(3)9-11-20)32(28(25)34)22-15-23(35-4)17-24(16-22)36-5/h8-17H,6-7,18H2,1-5H3