2-[(2-methylphenyl)methylsulfanyl]-3-(pyridin-3-ylmethyl)quinazolin-4-one

Systemtic Name: 2-[(2-methylphenyl)methylsulfanyl]-3-(pyridin-3-ylmethyl)quinazolin-4-one Openeye Name: 2-(o-tolylmethylsulfanyl)-3-(3-pyridylmethyl)quinazolin-4-one CAS Name: 2-[(2-methylphenyl)methylthio]-3-(3-pyridinylmethyl)-4-quinazolinone IUPAC Name: 2-[(2-methylphenyl)methylsulfanyl]-3-(pyridin-3-ylmethyl)quinazolin-4-one Traditional Name: 2-[(2-methylbenzyl)thio]-3-(3-pyridylmethyl)quinazolin-4-one Formula: C22H19N3OS MolecularWeight: 373.47076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC3=CC=CC=C3C(=O)N2CC4=CN=CC=C4

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC3=CC=CC=C3C(=O)N2CC4=CN=CC=C4

InChI

InChI=1S/C22H19N3OS/c1-16-7-2-3-9-18(16)15-27-22-24-20-11-5-4-10-19(20)21(26)25(22)14-17-8-6-12-23-13-17/h2-13H,14-15H2,1H3