6-chloranyl-2-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(2-methylpropyl)quinazolin-4-one

Systemtic Name: 6-chloranyl-2-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(2-methylpropyl)quinazolin-4-one Openeye Name: 6-chloro-3-isobutyl-2-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 6-chloro-2-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-3-(2-methylpropyl)-4-quinazolinone IUPAC Name: 6-chloro-2-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-3-(2-methylpropyl)quinazolin-4-one Traditional Name: 6-chloro-3-isobutyl-2-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]quinazolin-4-one Formula: C21H21ClN2O3S MolecularWeight: 416.92104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H21ClN2O3S/c1-13(2)11-24-20(26)17-10-15(22)6-9-18(17)23-21(24)28-12-19(25)14-4-7-16(27-3)8-5-14/h4-10,13H,11-12H2,1-3H3