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

Systemtic Name: (phenylmethyl) N-[5-[(4-azanylcyclohexyl)carbamoyl]-2-(4-cyclohexylcarbonylpiperazin-1-yl)phenyl]carbamate Openeye Name: benzyl N-[5-[(4-aminocyclohexyl)carbamoyl]-2-[4-(cyclohexanecarbonyl)piperazin-1-yl]phenyl]carbamate CAS Name: N-[5-[[(4-aminocyclohexyl)amino]-oxomethyl]-2-[4-[cyclohexyl(oxo)methyl]-1-piperazinyl]phenyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[5-[(4-aminocyclohexyl)carbamoyl]-2-[4-(cyclohexanecarbonyl)piperazin-1-yl]phenyl]carbamate Traditional Name: N-[5-[(4-aminocyclohexyl)carbamoyl]-2-[4-(cyclohexanecarbonyl)piperazino]phenyl]carbamic acid benzyl ester Formula: C32H43N5O4 MolecularWeight: 561.71492

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)NC4CCC(CC4)N)NC(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)NC4CCC(CC4)N)NC(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C32H43N5O4/c33-26-12-14-27(15-13-26)34-30(38)25-11-16-29(28(21-25)35-32(40)41-22-23-7-3-1-4-8-23)36-17-19-37(20-18-36)31(39)24-9-5-2-6-10-24/h1,3-4,7-8,11,16,21,24,26-27H,2,5-6,9-10,12-15,17-20,22,33H2,(H,34,38)(H,35,40)