7-chloranyl-3-(oxolan-2-ylmethyl)-2-[2-(phenylsulfinyl)ethylsulfanyl]quinazolin-4-one

Systemtic Name: 7-chloranyl-3-(oxolan-2-ylmethyl)-2-[2-(phenylsulfinyl)ethylsulfanyl]quinazolin-4-one Openeye Name: 2-[2-(benzenesulfinyl)ethylsulfanyl]-7-chloro-3-(tetrahydrofuran-2-ylmethyl)quinazolin-4-one CAS Name: 2-[2-(benzenesulfinyl)ethylthio]-7-chloro-3-(2-oxolanylmethyl)-4-quinazolinone IUPAC Name: 2-[2-(benzenesulfinyl)ethylsulfanyl]-7-chloro-3-(oxolan-2-ylmethyl)quinazolin-4-one Traditional Name: 2-[2-(benzenesulfinyl)ethylthio]-7-chloro-3-(tetrahydrofurfuryl)quinazolin-4-one Formula: C21H21ClN2O3S2 MolecularWeight: 448.98604

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCCS(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC(OC1)CN2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCCS(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H21ClN2O3S2/c22-15-8-9-18-19(13-15)23-21(24(20(18)25)14-16-5-4-10-27-16)28-11-12-29(26)17-6-2-1-3-7-17/h1-3,6-9,13,16H,4-5,10-12,14H2