7-chloranyl-3-(2-methoxyethyl)-2-[1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-quinazolin-4-one

Systemtic Name: 7-chloranyl-3-(2-methoxyethyl)-2-[1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-quinazolin-4-one Openeye Name: 7-chloro-3-(2-methoxyethyl)-2-[1-methyl-2-oxo-2-(p-tolyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 7-chloro-3-(2-methoxyethyl)-2-[[1-(4-methylphenyl)-1-oxopropan-2-yl]thio]-4-quinazolinone IUPAC Name: 7-chloro-3-(2-methoxyethyl)-2-[1-(4-methylphenyl)-1-oxopropan-2-yl]sulfanylquinazolin-4-one Traditional Name: 7-chloro-2-[[2-keto-1-methyl-2-(p-tolyl)ethyl]thio]-3-(2-methoxyethyl)quinazolin-4-one Formula: C21H21ClN2O3S MolecularWeight: 416.92104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)SC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCOC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(C)SC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCOC

InChI

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