(phenylmethyl) N-[2-(4-cyclopropylcarbonylpiperazin-1-yl)-5-piperazin-1-ylcarbonyl-phenyl]carbamate

Systemtic Name: (phenylmethyl) N-[2-(4-cyclopropylcarbonylpiperazin-1-yl)-5-piperazin-1-ylcarbonyl-phenyl]carbamate Openeye Name: benzyl N-[2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]carbamate CAS Name: N-[2-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-5-[oxo(1-piperazinyl)methyl]phenyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]carbamate Traditional Name: N-[2-[4-(cyclopropanecarbonyl)piperazino]-5-(piperazine-1-carbonyl)phenyl]carbamic acid benzyl ester Formula: C27H33N5O4 MolecularWeight: 491.58202

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)N4CCNCC4)NC(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1CC1C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)N4CCNCC4)NC(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C27H33N5O4/c33-25(21-6-7-21)32-16-14-30(15-17-32)24-9-8-22(26(34)31-12-10-28-11-13-31)18-23(24)29-27(35)36-19-20-4-2-1-3-5-20/h1-5,8-9,18,21,28H,6-7,10-17,19H2,(H,29,35)