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

Systemtic Name: 3-cyclopentyl-2-[1-(4-ethylpiperazin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-quinazolin-4-one Openeye Name: 3-cyclopentyl-2-[2-(4-ethylpiperazin-1-yl)-1-methyl-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-cyclopentyl-2-[[1-(4-ethyl-1-piperazinyl)-1-oxopropan-2-yl]thio]-4-quinazolinone IUPAC Name: 3-cyclopentyl-2-[1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]sulfanylquinazolin-4-one Traditional Name: 3-cyclopentyl-2-[[2-(4-ethylpiperazino)-2-keto-1-methyl-ethyl]thio]quinazolin-4-one Formula: C22H30N4O2S MolecularWeight: 414.5642

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4CCCC4

Isomeric SMILES

CCN1CCN(CC1)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4CCCC4

InChI

InChI=1S/C22H30N4O2S/c1-3-24-12-14-25(15-13-24)20(27)16(2)29-22-23-19-11-7-6-10-18(19)21(28)26(22)17-8-4-5-9-17/h6-7,10-11,16-17H,3-5,8-9,12-15H2,1-2H3