3-(3-chloranyl-4-methyl-phenyl)-2-[2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(3-chloranyl-4-methyl-phenyl)-2-[2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(3-chloro-4-methyl-phenyl)-2-[2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(3-chloro-4-methylphenyl)-2-[[2-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 3-(3-chloro-4-methylphenyl)-2-[2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl]sulfanylquinazolin-4-one Traditional Name: 3-(3-chloro-4-methyl-phenyl)-2-[[2-[4-(2-furoyl)piperazino]-2-keto-ethyl]thio]quinazolin-4-one Formula: C26H23ClN4O4S MolecularWeight: 523.00322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N4CCN(CC4)C(=O)C5=CC=CO5)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N4CCN(CC4)C(=O)C5=CC=CO5)Cl

InChI

InChI=1S/C26H23ClN4O4S/c1-17-8-9-18(15-20(17)27)31-24(33)19-5-2-3-6-21(19)28-26(31)36-16-23(32)29-10-12-30(13-11-29)25(34)22-7-4-14-35-22/h2-9,14-15H,10-13,16H2,1H3