3-(2,6-dimethylphenyl)-2-[1-(4-ethylpiperazin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(2,6-dimethylphenyl)-2-[1-(4-ethylpiperazin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-quinazolin-4-one Openeye Name: 3-(2,6-dimethylphenyl)-2-[2-(4-ethylpiperazin-1-yl)-1-methyl-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(2,6-dimethylphenyl)-2-[[1-(4-ethyl-1-piperazinyl)-1-oxopropan-2-yl]thio]-4-quinazolinone IUPAC Name: 3-(2,6-dimethylphenyl)-2-[1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]sulfanylquinazolin-4-one Traditional Name: 3-(2,6-dimethylphenyl)-2-[[2-(4-ethylpiperazino)-2-keto-1-methyl-ethyl]thio]quinazolin-4-one Formula: C25H30N4O2S MolecularWeight: 450.5963

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4=C(C=CC=C4C)C

Isomeric SMILES

CCN1CCN(CC1)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4=C(C=CC=C4C)C

InChI

InChI=1S/C25H30N4O2S/c1-5-27-13-15-28(16-14-27)23(30)19(4)32-25-26-21-12-7-6-11-20(21)24(31)29(25)22-17(2)9-8-10-18(22)3/h6-12,19H,5,13-16H2,1-4H3