3-(3,5-dimethoxyphenyl)-2-[(4-methylphenyl)methylsulfanyl]-7-piperidin-1-ylcarbonyl-quinazolin-4-one

Systemtic Name: 3-(3,5-dimethoxyphenyl)-2-[(4-methylphenyl)methylsulfanyl]-7-piperidin-1-ylcarbonyl-quinazolin-4-one Openeye Name: 3-(3,5-dimethoxyphenyl)-7-(piperidine-1-carbonyl)-2-(p-tolylmethylsulfanyl)quinazolin-4-one CAS Name: 3-(3,5-dimethoxyphenyl)-2-[(4-methylphenyl)methylthio]-7-[oxo(1-piperidinyl)methyl]-4-quinazolinone IUPAC Name: 3-(3,5-dimethoxyphenyl)-2-[(4-methylphenyl)methylsulfanyl]-7-(piperidine-1-carbonyl)quinazolin-4-one Traditional Name: 3-(3,5-dimethoxyphenyl)-2-[(4-methylbenzyl)thio]-7-(piperidine-1-carbonyl)quinazolin-4-one Formula: C30H31N3O4S MolecularWeight: 529.64984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC3=C(C=CC(=C3)C(=O)N4CCCCC4)C(=O)N2C5=CC(=CC(=C5)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC3=C(C=CC(=C3)C(=O)N4CCCCC4)C(=O)N2C5=CC(=CC(=C5)OC)OC

InChI

InChI=1S/C30H31N3O4S/c1-20-7-9-21(10-8-20)19-38-30-31-27-15-22(28(34)32-13-5-4-6-14-32)11-12-26(27)29(35)33(30)23-16-24(36-2)18-25(17-23)37-3/h7-12,15-18H,4-6,13-14,19H2,1-3H3