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

Systemtic Name: 3-(4-ethylphenyl)-2-[1-(4-ethylpiperazin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-quinazolin-4-one Openeye Name: 3-(4-ethylphenyl)-2-[2-(4-ethylpiperazin-1-yl)-1-methyl-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(4-ethylphenyl)-2-[[1-(4-ethyl-1-piperazinyl)-1-oxopropan-2-yl]thio]-4-quinazolinone IUPAC Name: 3-(4-ethylphenyl)-2-[1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]sulfanylquinazolin-4-one Traditional Name: 3-(4-ethylphenyl)-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:

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)N4CCN(CC4)CC

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)N4CCN(CC4)CC

InChI

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