methyl N-[2-(4-cyclobutylcarbonylpiperazin-1-yl)-5-piperazin-1-ylcarbonyl-phenyl]carbamate

Systemtic Name: methyl N-[2-(4-cyclobutylcarbonylpiperazin-1-yl)-5-piperazin-1-ylcarbonyl-phenyl]carbamate Openeye Name: methyl N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]carbamate CAS Name: N-[2-[4-[cyclobutyl(oxo)methyl]-1-piperazinyl]-5-[oxo(1-piperazinyl)methyl]phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]carbamate Traditional Name: N-[2-[4-(cyclobutanecarbonyl)piperazino]-5-(piperazine-1-carbonyl)phenyl]carbamic acid methyl ester Formula: C22H31N5O4 MolecularWeight: 429.51264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=C(C=CC(=C1)C(=O)N2CCNCC2)N3CCN(CC3)C(=O)C4CCC4

Isomeric SMILES

COC(=O)NC1=C(C=CC(=C1)C(=O)N2CCNCC2)N3CCN(CC3)C(=O)C4CCC4

InChI

InChI=1S/C22H31N5O4/c1-31-22(30)24-18-15-17(21(29)26-9-7-23-8-10-26)5-6-19(18)25-11-13-27(14-12-25)20(28)16-3-2-4-16/h5-6,15-16,23H,2-4,7-14H2,1H3,(H,24,30)