3-(2,2-diethoxyethyl)-2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(2,2-diethoxyethyl)-2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(2,2-diethoxyethyl)-2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(2,2-diethoxyethyl)-2-[[2-[4-(2-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 3-(2,2-diethoxyethyl)-2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]sulfanylquinazolin-4-one Traditional Name: 3-(2,2-diethoxyethyl)-2-[[2-keto-2-[4-(2-methoxyphenyl)piperazino]ethyl]thio]quinazolin-4-one Formula: C27H34N4O5S MolecularWeight: 526.64766

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N3CCN(CC3)C4=CC=CC=C4OC)OCC

Isomeric SMILES

CCOC(CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N3CCN(CC3)C4=CC=CC=C4OC)OCC

InChI

InChI=1S/C27H34N4O5S/c1-4-35-25(36-5-2)18-31-26(33)20-10-6-7-11-21(20)28-27(31)37-19-24(32)30-16-14-29(15-17-30)22-12-8-9-13-23(22)34-3/h6-13,25H,4-5,14-19H2,1-3H3