3-azanyl-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylsulfanyl]quinazolin-4-one

Systemtic Name: 3-azanyl-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylsulfanyl]quinazolin-4-one Openeye Name: 3-amino-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylsulfanyl]quinazolin-4-one CAS Name: 3-amino-2-[3-[4-(2-methoxyphenyl)-1-piperazinyl]propylthio]-4-quinazolinone IUPAC Name: 3-amino-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylsulfanyl]quinazolin-4-one Traditional Name: 3-amino-2-[3-[4-(2-methoxyphenyl)piperazino]propylthio]quinazolin-4-one Formula: C22H27N5O2S MolecularWeight: 425.54708

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCCSC3=NC4=CC=CC=C4C(=O)N3N

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCCSC3=NC4=CC=CC=C4C(=O)N3N

InChI

InChI=1S/C22H27N5O2S/c1-29-20-10-5-4-9-19(20)26-14-12-25(13-15-26)11-6-16-30-22-24-18-8-3-2-7-17(18)21(28)27(22)23/h2-5,7-10H,6,11-16,23H2,1H3