2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-3-(3-methoxypropyl)quinazolin-4-one

Systemtic Name: 2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-3-(3-methoxypropyl)quinazolin-4-one Openeye Name: 2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-3-(3-methoxypropyl)quinazolin-4-one CAS Name: 2-[2-(4-chlorophenyl)sulfonylethylthio]-3-(3-methoxypropyl)-4-quinazolinone IUPAC Name: 2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-3-(3-methoxypropyl)quinazolin-4-one Traditional Name: 2-[2-(4-chlorophenyl)sulfonylethylthio]-3-(3-methoxypropyl)quinazolin-4-one Formula: C20H21ClN2O4S2 MolecularWeight: 452.97474

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=CC=CC=C2N=C1SCCS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COCCCN1C(=O)C2=CC=CC=C2N=C1SCCS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H21ClN2O4S2/c1-27-12-4-11-23-19(24)17-5-2-3-6-18(17)22-20(23)28-13-14-29(25,26)16-9-7-15(21)8-10-16/h2-3,5-10H,4,11-14H2,1H3