2-[1-(4-cyclohexylcarbonyl-3-methyl-piperazin-1-yl)ethyl]-3-(2-methoxyphenyl)quinazolin-4-one

Systemtic Name: 2-[1-(4-cyclohexylcarbonyl-3-methyl-piperazin-1-yl)ethyl]-3-(2-methoxyphenyl)quinazolin-4-one Openeye Name: 2-[1-[4-(cyclohexanecarbonyl)-3-methyl-piperazin-1-yl]ethyl]-3-(2-methoxyphenyl)quinazolin-4-one CAS Name: 2-[1-[4-[cyclohexyl(oxo)methyl]-3-methyl-1-piperazinyl]ethyl]-3-(2-methoxyphenyl)-4-quinazolinone IUPAC Name: 2-[1-[4-(cyclohexanecarbonyl)-3-methylpiperazin-1-yl]ethyl]-3-(2-methoxyphenyl)quinazolin-4-one Traditional Name: 2-[1-[4-(cyclohexanecarbonyl)-3-methyl-piperazino]ethyl]-3-(2-methoxyphenyl)quinazolin-4-one Formula: C29H36N4O3 MolecularWeight: 488.62114

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2CCCCC2)C(C)C3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5OC

Isomeric SMILES

CC1CN(CCN1C(=O)C2CCCCC2)C(C)C3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5OC

InChI

InChI=1S/C29H36N4O3/c1-20-19-31(17-18-32(20)28(34)22-11-5-4-6-12-22)21(2)27-30-24-14-8-7-13-23(24)29(35)33(27)25-15-9-10-16-26(25)36-3/h7-10,13-16,20-22H,4-6,11-12,17-19H2,1-3H3