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

Systemtic Name: 7-chloranyl-2-[1-(4-ethylpiperazin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-(3-methylphenyl)quinazolin-4-one Openeye Name: 7-chloro-2-[2-(4-ethylpiperazin-1-yl)-1-methyl-2-oxo-ethyl]sulfanyl-3-(m-tolyl)quinazolin-4-one CAS Name: 7-chloro-2-[[1-(4-ethyl-1-piperazinyl)-1-oxopropan-2-yl]thio]-3-(3-methylphenyl)-4-quinazolinone IUPAC Name: 7-chloro-2-[1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]sulfanyl-3-(3-methylphenyl)quinazolin-4-one Traditional Name: 7-chloro-2-[[2-(4-ethylpiperazino)-2-keto-1-methyl-ethyl]thio]-3-(m-tolyl)quinazolin-4-one Formula: C24H27ClN4O2S MolecularWeight: 471.01478

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C(C)SC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C4=CC=CC(=C4)C

Isomeric SMILES

CCN1CCN(CC1)C(=O)C(C)SC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C4=CC=CC(=C4)C

InChI

InChI=1S/C24H27ClN4O2S/c1-4-27-10-12-28(13-11-27)22(30)17(3)32-24-26-21-15-18(25)8-9-20(21)23(31)29(24)19-7-5-6-16(2)14-19/h5-9,14-15,17H,4,10-13H2,1-3H3