2-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-3-(oxolan-2-ylmethyl)quinazolin-4-one

Systemtic Name: 2-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-3-(oxolan-2-ylmethyl)quinazolin-4-one Openeye Name: 2-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-3-(tetrahydrofuran-2-ylmethyl)quinazolin-4-one CAS Name: 2-[2-(3,5-dimethylphenoxy)ethylthio]-3-(2-oxolanylmethyl)-4-quinazolinone IUPAC Name: 2-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-3-(oxolan-2-ylmethyl)quinazolin-4-one Traditional Name: 2-[2-(3,5-dimethylphenoxy)ethylthio]-3-(tetrahydrofurfuryl)quinazolin-4-one Formula: C23H26N2O3S MolecularWeight: 410.52914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCSC2=NC3=CC=CC=C3C(=O)N2CC4CCCO4)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCSC2=NC3=CC=CC=C3C(=O)N2CC4CCCO4)C

InChI

InChI=1S/C23H26N2O3S/c1-16-12-17(2)14-19(13-16)28-10-11-29-23-24-21-8-4-3-7-20(21)22(26)25(23)15-18-6-5-9-27-18/h3-4,7-8,12-14,18H,5-6,9-11,15H2,1-2H3