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

Systemtic Name: methyl N-[2-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]carbamate Openeye Name: methyl N-[2-[4-(4-tert-butylbenzoyl)piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]carbamate CAS Name: N-[2-[4-[(4-tert-butylphenyl)-oxomethyl]-1-piperazinyl]-5-[oxo(1-piperazinyl)methyl]phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[2-[4-(4-tert-butylbenzoyl)piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]carbamate Traditional Name: N-[2-[4-(4-tert-butylbenzoyl)piperazino]-5-(piperazine-1-carbonyl)phenyl]carbamic acid methyl ester Formula: C28H37N5O4 MolecularWeight: 507.62448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)N4CCNCC4)NC(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)N4CCNCC4)NC(=O)OC

InChI

InChI=1S/C28H37N5O4/c1-28(2,3)22-8-5-20(6-9-22)25(34)33-17-15-31(16-18-33)24-10-7-21(19-23(24)30-27(36)37-4)26(35)32-13-11-29-12-14-32/h5-10,19,29H,11-18H2,1-4H3,(H,30,36)