3-(3-methoxyphenyl)-2-[(3-methoxyphenyl)methylsulfanyl]-7-piperidin-1-ylcarbonyl-quinazolin-4-one

Systemtic Name: 3-(3-methoxyphenyl)-2-[(3-methoxyphenyl)methylsulfanyl]-7-piperidin-1-ylcarbonyl-quinazolin-4-one Openeye Name: 3-(3-methoxyphenyl)-2-[(3-methoxyphenyl)methylsulfanyl]-7-(piperidine-1-carbonyl)quinazolin-4-one CAS Name: 3-(3-methoxyphenyl)-2-[(3-methoxyphenyl)methylthio]-7-[oxo(1-piperidinyl)methyl]-4-quinazolinone IUPAC Name: 3-(3-methoxyphenyl)-2-[(3-methoxyphenyl)methylsulfanyl]-7-(piperidine-1-carbonyl)quinazolin-4-one Traditional Name: 2-(m-anisylthio)-3-(3-methoxyphenyl)-7-(piperidine-1-carbonyl)quinazolin-4-one Formula: C29H29N3O4S MolecularWeight: 515.62326

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CSC2=NC3=C(C=CC(=C3)C(=O)N4CCCCC4)C(=O)N2C5=CC(=CC=C5)OC

Isomeric SMILES

COC1=CC=CC(=C1)CSC2=NC3=C(C=CC(=C3)C(=O)N4CCCCC4)C(=O)N2C5=CC(=CC=C5)OC

InChI

InChI=1S/C29H29N3O4S/c1-35-23-10-6-8-20(16-23)19-37-29-30-26-17-21(27(33)31-14-4-3-5-15-31)12-13-25(26)28(34)32(29)22-9-7-11-24(18-22)36-2/h6-13,16-18H,3-5,14-15,19H2,1-2H3