3-(2,5-dimethoxyphenyl)-2-[2-(3-methyl-4-propan-2-yl-phenoxy)ethylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(2,5-dimethoxyphenyl)-2-[2-(3-methyl-4-propan-2-yl-phenoxy)ethylsulfanyl]quinazolin-4-one Openeye Name: 3-(2,5-dimethoxyphenyl)-2-[2-(4-isopropyl-3-methyl-phenoxy)ethylsulfanyl]quinazolin-4-one CAS Name: 3-(2,5-dimethoxyphenyl)-2-[2-(3-methyl-4-propan-2-ylphenoxy)ethylthio]-4-quinazolinone IUPAC Name: 3-(2,5-dimethoxyphenyl)-2-[2-(3-methyl-4-propan-2-ylphenoxy)ethylsulfanyl]quinazolin-4-one Traditional Name: 3-(2,5-dimethoxyphenyl)-2-[2-(4-isopropyl-3-methyl-phenoxy)ethylthio]quinazolin-4-one Formula: C28H30N2O4S MolecularWeight: 490.6138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCSC2=NC3=CC=CC=C3C(=O)N2C4=C(C=CC(=C4)OC)OC)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCCSC2=NC3=CC=CC=C3C(=O)N2C4=C(C=CC(=C4)OC)OC)C(C)C

InChI

InChI=1S/C28H30N2O4S/c1-18(2)22-12-10-21(16-19(22)3)34-14-15-35-28-29-24-9-7-6-8-23(24)27(31)30(28)25-17-20(32-4)11-13-26(25)33-5/h6-13,16-18H,14-15H2,1-5H3