(phenylmethyl) N-[5-[(4-azanylcyclohexyl)carbamoyl]-2-(4-cyclobutylcarbonylpiperazin-1-yl)phenyl]carbamate

Systemtic Name: (phenylmethyl) N-[5-[(4-azanylcyclohexyl)carbamoyl]-2-(4-cyclobutylcarbonylpiperazin-1-yl)phenyl]carbamate Openeye Name: benzyl N-[5-[(4-aminocyclohexyl)carbamoyl]-2-[4-(cyclobutanecarbonyl)piperazin-1-yl]phenyl]carbamate CAS Name: N-[5-[[(4-aminocyclohexyl)amino]-oxomethyl]-2-[4-[cyclobutyl(oxo)methyl]-1-piperazinyl]phenyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[5-[(4-aminocyclohexyl)carbamoyl]-2-[4-(cyclobutanecarbonyl)piperazin-1-yl]phenyl]carbamate Traditional Name: N-[5-[(4-aminocyclohexyl)carbamoyl]-2-[4-(cyclobutanecarbonyl)piperazino]phenyl]carbamic acid benzyl ester Formula: C30H39N5O4 MolecularWeight: 533.66176

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)NC4CCC(CC4)N)NC(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1CC(C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)NC4CCC(CC4)N)NC(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C30H39N5O4/c31-24-10-12-25(13-11-24)32-28(36)23-9-14-27(34-15-17-35(18-16-34)29(37)22-7-4-8-22)26(19-23)33-30(38)39-20-21-5-2-1-3-6-21/h1-3,5-6,9,14,19,22,24-25H,4,7-8,10-13,15-18,20,31H2,(H,32,36)(H,33,38)