2-[2-(3-chloranylphenoxy)ethylsulfanyl]-3-(pyridin-3-ylmethyl)quinazolin-4-one

Systemtic Name: 2-[2-(3-chloranylphenoxy)ethylsulfanyl]-3-(pyridin-3-ylmethyl)quinazolin-4-one Openeye Name: 2-[2-(3-chlorophenoxy)ethylsulfanyl]-3-(3-pyridylmethyl)quinazolin-4-one CAS Name: 2-[2-(3-chlorophenoxy)ethylthio]-3-(3-pyridinylmethyl)-4-quinazolinone IUPAC Name: 2-[2-(3-chlorophenoxy)ethylsulfanyl]-3-(pyridin-3-ylmethyl)quinazolin-4-one Traditional Name: 2-[2-(3-chlorophenoxy)ethylthio]-3-(3-pyridylmethyl)quinazolin-4-one Formula: C22H18ClN3O2S MolecularWeight: 423.91522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCCOC3=CC(=CC=C3)Cl)CC4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCCOC3=CC(=CC=C3)Cl)CC4=CN=CC=C4

InChI

InChI=1S/C22H18ClN3O2S/c23-17-6-3-7-18(13-17)28-11-12-29-22-25-20-9-2-1-8-19(20)21(27)26(22)15-16-5-4-10-24-14-16/h1-10,13-14H,11-12,15H2